A QTAIM and DFT study of the dizinc bond in non-symmetric [CpZn2Ln] complexes
Several [Zn2L2] and [CpZn2Ln] dizinc compounds have been studied by density functional theory (DFT) and quantum theory of atoms in molecules (QTAIM) in order to compare the nature and topology of the Zn–Zn bond in symmetrical and non-symmetrical complexes. The stability of these complexes have been...
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| Published in | Journal of organometallic chemistry Vol. 898; p. 120878 |
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| Main Authors | , |
| Format | Journal Article |
| Language | English |
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Elsevier B.V
15.10.2019
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| Abstract | Several [Zn2L2] and [CpZn2Ln] dizinc compounds have been studied by density functional theory (DFT) and quantum theory of atoms in molecules (QTAIM) in order to compare the nature and topology of the Zn–Zn bond in symmetrical and non-symmetrical complexes. The stability of these complexes have been evaluated on the basis of the formation energies. The disproportionation reaction has also been analysed indicating that symmetric complexes are less stable than non-symmetric ones. To certain extent, the properties of the [CpZn2Ln] complexes are between those of the [Zn2L2] and [Zn2Cp2] compounds. The asymmetry of the [CpZn2Ln] compounds is illustrated in terms of the topological properties, especially in the Source Function (SF) and Natural Bond Orbital (NBO) analysis.
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•A theoretical study of non-symmetric complexes [CpZn2Ln] has been carried out.•Complex formation is exergonic, while disproportionation is endergonic.•Cyclopentadienyl substituent favours the dizinc bond strength.•Increasing the steric protection of [ZnLn] fragment stabilizes Zn–Zn bond.•Source Function and NBO analyses allow to differentiate non-symmetric compounds. |
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| AbstractList | Several [Zn2L2] and [CpZn2Ln] dizinc compounds have been studied by density functional theory (DFT) and quantum theory of atoms in molecules (QTAIM) in order to compare the nature and topology of the Zn–Zn bond in symmetrical and non-symmetrical complexes. The stability of these complexes have been evaluated on the basis of the formation energies. The disproportionation reaction has also been analysed indicating that symmetric complexes are less stable than non-symmetric ones. To certain extent, the properties of the [CpZn2Ln] complexes are between those of the [Zn2L2] and [Zn2Cp2] compounds. The asymmetry of the [CpZn2Ln] compounds is illustrated in terms of the topological properties, especially in the Source Function (SF) and Natural Bond Orbital (NBO) analysis.
[Display omitted]
•A theoretical study of non-symmetric complexes [CpZn2Ln] has been carried out.•Complex formation is exergonic, while disproportionation is endergonic.•Cyclopentadienyl substituent favours the dizinc bond strength.•Increasing the steric protection of [ZnLn] fragment stabilizes Zn–Zn bond.•Source Function and NBO analyses allow to differentiate non-symmetric compounds. |
| ArticleNumber | 120878 |
| Author | Galindo, Agustín Ayala, Regla |
| Author_xml | – sequence: 1 givenname: Regla surname: Ayala fullname: Ayala, Regla email: rae@us.es organization: Departamento de Química Inorgánica, Facultad de Química, Universidad de Sevilla, Aptdo 1203, 41071, Sevilla, Spain – sequence: 2 givenname: Agustín orcidid: 0000-0002-2772-9171 surname: Galindo fullname: Galindo, Agustín email: galindo@us.es organization: Departamento de Química Inorgánica, Facultad de Química, Universidad de Sevilla, Aptdo 1203, 41071, Sevilla, Spain |
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| Cites_doi | 10.1021/om200430t 10.1016/j.chemphys.2006.04.021 10.1002/anie.201410737 10.1021/jp311683p 10.1016/j.theochem.2006.06.040 10.1002/anie.200462175 10.1016/j.ccr.2008.01.014 10.1016/j.jorganchem.2006.10.067 10.1039/b508541a 10.1016/j.cplett.2005.01.086 10.1103/PhysRevA.38.3098 10.1002/anie.201005808 10.1039/C8SC03902J 10.1021/om901013b 10.1021/jp044293k 10.1021/ja0668217 10.1021/jp805291e 10.1126/science.1101356 10.1107/S0108768107045880 10.1002/chem.201705173 10.1002/chem.201002482 10.1016/j.chemphys.2007.01.024 10.1039/B703200E 10.1039/c0cc02859b 10.1039/b904478g 10.1016/j.cplett.2004.02.043 10.1021/jp407876a 10.1002/jcc.22885 10.1002/anie.201504818 10.1002/jcc.10205 10.1142/S0219633606002398 10.1021/ic201701r 10.1016/S0010-8545(02)00252-7 10.1002/anie.200902202 10.1002/anie.200605251 10.1021/ic502532g 10.1016/j.theochem.2006.08.038 10.1021/ja053819r 10.1002/anie.200601926 10.1002/anie.200704568 10.1002/jcc.20495 10.1039/C6SC02106A 10.1103/PhysRevB.33.8822 10.1039/C8DT04651D 10.1021/om900291x 10.1021/jp051065x 10.1016/j.theochem.2006.11.007 10.1007/s00706-005-0307-x 10.1063/1.1501133 10.1021/ja072682x 10.1002/qua.25823 10.1002/chem.201801227 10.1039/c3dt51230d 10.1016/j.ica.2017.06.008 10.1021/om900408a 10.1039/b707396h 10.1021/om200868j 10.1002/anie.200803736 10.1039/b515623h 10.1016/j.ccr.2004.08.022 10.1002/chem.201202560 10.1016/j.theochem.2005.10.025 10.1021/om801155j 10.1021/cr00005a013 10.1016/j.cplett.2005.08.122 10.1002/anie.201702171 10.1021/ja982903m 10.1021/om800405m 10.1021/ja042754+ 10.1021/jacs.8b12494 10.1039/c2cs15343b 10.1002/chem.201002443 10.1038/ncomms7331 |
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| References | del Río, Galindo, Resa, Carmona (bib4) 2005; 44 Xie, Schaefer, King, Kang, Xie, Fang, Kress, Richardson, Barnah, Pederson, Liu, Tian, Feng, Zhang, Li, Philpott, Kawazoe, Philpott, Kawazoe, Philpott, Kawazoe, Wang, Yang, Wan, Han, Pandey, Philpott, Kawazoe, Kan (bib20) 2005; 127 Carmona, Galindo, Grirrane, Resa, Rodríguez, Carmona (bib12) 2008; 47 Ayala, Galindo (bib23) 2019; 119 Cui, Hu, Zhao, Miller, Cheng, Li, Hu, Zhao, Hu, Cui, Hu, Cheng, Li, Zhao (bib25) 2015; 6 Chen, Jiang, Maron, Xu (bib19) 2019; 48 Bader, Bader, Bader, Cortés-Guzmán, Bader, Popelier (bib28) 1990; 136 Banh, Hornung, Kratz, Gemel, Pöthig, Gam, Kahlal, Saillard, Fischer, Mayer, Jantke, Schulz, Fässler, Freitag, Gemel, Jerabek, Oppel, Seidel, Frenking, Banh, Dilchert, Fischer (bib17) 2018; 9 Cushion, Meyer, Heath, Schwarz, Fernández, Breher, Mountford (bib36) 2010; 29 Bruno, Lightfoot, Ward (bib40) 2016; B72 Zhu, Fettinger, Olmstead, Power (bib43) 2009; 28 Espinosa, Alkorta, Elguero, Molins (bib47) 2002; 117 Schulz, Gondzik, Schuchmann, Westphal, Dobrzycki, Boese, Harder (bib41) 2010; 46 Becke, Perdew (bib29) 1988; 38 01, Frisch, Trucks, Schlegel, Scuseria, Robb, Cheeseman, Scalmani, Barone, Mennucci, Petersson, Nakatsuji, Caricato, Li, Hratchian, Izmaylov, Bloino, Zheng, Sonnenberg, Hada, Ehara, Toyota, Fukuda, Hasegawa, Ishida, Nakajima, Honda, Kitao, Nakai, Vreven, Montgomery, Peralta, Ogliaro, Bearpark, Heyd, Brothers, Kudin, Staroverov, Kobayashi, Normand, Raghavachari, Rendell, Burant, Iyengar, Tomasi, Cossi, Rega, Millam, Klene, Knox, Cross, Bakken, Adamo, Jaramillo, Gomperts, Stratmann, Yazyev, Austin, Cammi, Pomelli, Ochterski, Martin, Morokuma, Zakrzewski, Voth, Salvador, Dannenberg, Dapprich, Daniels, Farkas, Foresman, Ortiz, Cioslowski, Fox (bib32) 2009 Liu, Li, Yang, Yang, Gao, Xia, Wu, Stasch, Hicks, Underhill, Kefalidis, Maron, Jones (bib16) 2009; 28 Grirrane, Resa, Rodríguez, Carmona, Álvarez, Gutiérrez-Puebla, Monge, Galindo, del Río, Andersen (bib2) 2007; 129 Resa, Carmona, Gutiérrez Puebla, Monge (bib3) 2004; 305 Tsai, Lu, Lin, Hwang, Yub, Yu, Yang, Liu, Pu, Li, Xie, Schaefer, Wu (bib10) 2007; 27 Weigend, Ahlrichs, Weigend (bib30) 2005; 7 Macchi, Proserpio, Sironi, Macchi, Sironi (bib45) 1998; 120 van der Maelen, Gutiérrez-Puebla, Monge, García-Granda, Resa, Carmona, Fernández-Díaz, McIntyre, Pattison, Weber (bib6) 2007; B63 Schulz, Schuchmann, Krossing, Himmel, Bläser, Boese (bib14) 2009; 48 Li, Schulz, Roesky (bib13) 2012; 41 Wang, Quillian, Wei, Wang, Yang, Xie, King, Schleyer, Schaefer, Robinson (bib42) 2005; 127 Yang, Yu, Liu, Xie, Schaefer, Liang, Wu (bib37) 2007 Keith (bib33) 2012 Lu, Chen (bib34) 2012; 33 Yang, Yang, Yu, Liu, Zhang, Deng, Wu (bib38) 2009 Bollermann, Freitag, Gemel, Molon, Seidel, Jerabek, Frenking, Fischer, Bollermann, Freitag, Gemel, Seidel, Fischer, Bollermann, Freitag, Gemel, Seidel, von Hopffgarten, Frenking, Fischer (bib35) 2011; 50 Gatti, Cargnoni, Bertini (bib48) 2003; 24 Resa, Carmona, Gutiérrez Puebla, Monge (bib1) 2004; 305 Parr, Yang (bib27) 1989 Grimme, Grimme, Antony, Ehrlich, Krieg (bib31) 2006; 27 Schuchmann, Westphal, Schulz, Flörke, Bläser, Boese, Nayek, Lühl, Schulz, Köppe, Roesky (bib11) 2009; 48 Hepperle, Wang, Hepperle, Wang (bib24) 2013; 117 Gervasio, Bianchi, Marabello (bib46) 2004; 387 Lohrey, Maron, Bergman, Arnold (bib18) 2019; 141 Freitag, Molon, Jerabek, Dilchert, Rösler, Seidel, Gemel, Frenking, Fischer (bib21) 2016; 7 Zhu, Wright, Olmstead, Rivard, Brynda, Power, Zhu, Brynda, Wright, Fischer, Merrill, Rivard, Wolf, Fettinger, Olmstead, Power, Freitag, Banh, Ganesamoorthy, Gemel, Seidel, Fischer (bib8) 2006; 45 Echeverría, Falceto, Alvarez (bib22) 2017; 56 Gao, Li, Zhao, Wu, Yang (bib39) 2012; 31 Ayala, Carmona, Galindo (bib26) 2018; 470 Grirrane, Resa, Rodríguez, Carmona, Álvarez, Gutiérrez-Puebla, Monge, Galindo, del Río, Andersen (bib5) 2007; 129 Freitag, Banh, Gemel, Jerabek, Seidel, Frenking, Fischer (bib15) 2015; 54 del Río, Resa, Rodríguez, Sánchez, Köppe, Downs, Tang, Carmona (bib7) 2008; 112 Fedushkin, Skatova, Ketkov, Eremenko, Piskunov, Fukin, Fedushkin, Eremenko, Skatova, Piskunov, Fukin, Ketkov (bib9) 2007; 46 Gondzik, Bläser, Wölper, Schulz (bib44) 2010; 16 Freitag (10.1016/j.jorganchem.2019.120878_bib21) 2016; 7 Cui (10.1016/j.jorganchem.2019.120878_bib25a) 2015; 6 Parr (10.1016/j.jorganchem.2019.120878_bib27) 1989 Freitag (10.1016/j.jorganchem.2019.120878_bib15) 2015; 54 Grimme (10.1016/j.jorganchem.2019.120878_bib31a) 2006; 27 Gatti (10.1016/j.jorganchem.2019.120878_bib48) 2003; 24 Richardson (10.1016/j.jorganchem.2019.120878_bib20e) 2005; 415 Resa (10.1016/j.jorganchem.2019.120878_bib3) 2004; 305 Wang (10.1016/j.jorganchem.2019.120878_bib42) 2005; 127 Hu (10.1016/j.jorganchem.2019.120878_bib25c) 2018; 24 Weigend (10.1016/j.jorganchem.2019.120878_bib30a) 2005; 7 Hepperle (10.1016/j.jorganchem.2019.120878_bib24b) 2013; 117 Chen (10.1016/j.jorganchem.2019.120878_bib19) 2019; 48 Wang (10.1016/j.jorganchem.2019.120878_bib20j) 2006; 5 Bollermann (10.1016/j.jorganchem.2019.120878_bib35c) 2011; 50 Yang (10.1016/j.jorganchem.2019.120878_bib37) 2007 Philpott (10.1016/j.jorganchem.2019.120878_bib20i) 2006; 776 Schulz (10.1016/j.jorganchem.2019.120878_bib14) 2009; 48 Grirrane (10.1016/j.jorganchem.2019.120878_bib12b) 2008; 252 Tsai (10.1016/j.jorganchem.2019.120878_bib10a) 2007 Kan (10.1016/j.jorganchem.2019.120878_bib20n) 2007; 805 Hepperle (10.1016/j.jorganchem.2019.120878_bib24a) 2013; 117 van der Maelen (10.1016/j.jorganchem.2019.120878_bib6) 2007; B63 Kress (10.1016/j.jorganchem.2019.120878_bib20d) 2005; 109 Schulz (10.1016/j.jorganchem.2019.120878_bib41) 2010; 46 Li (10.1016/j.jorganchem.2019.120878_bib13) 2012; 41 01 (10.1016/j.jorganchem.2019.120878_bib32) 2009 Resa (10.1016/j.jorganchem.2019.120878_bib1) 2004; 305 Bruno (10.1016/j.jorganchem.2019.120878_bib40) 2016; B72 Hicks (10.1016/j.jorganchem.2019.120878_bib16c) 2015; 54 Macchi (10.1016/j.jorganchem.2019.120878_bib45a) 1998; 120 Liu (10.1016/j.jorganchem.2019.120878_bib20f) 2006; 758 Nayek (10.1016/j.jorganchem.2019.120878_bib11b) 2011; 17 Cushion (10.1016/j.jorganchem.2019.120878_bib36) 2010; 29 Philpott (10.1016/j.jorganchem.2019.120878_bib20m) 2007; 333 Cortés-Guzmán (10.1016/j.jorganchem.2019.120878_bib28d) 2005; 249 Banh (10.1016/j.jorganchem.2019.120878_bib17a) 2018; 9 Grimme (10.1016/j.jorganchem.2019.120878_bib31b) 2010; 132 Hu (10.1016/j.jorganchem.2019.120878_bib25b) 2018; 24 Ayala (10.1016/j.jorganchem.2019.120878_bib23) 2019; 119 Bollermann (10.1016/j.jorganchem.2019.120878_bib35a) 2011; 50 Zhu (10.1016/j.jorganchem.2019.120878_bib8a) 2006; 45 Fedushkin (10.1016/j.jorganchem.2019.120878_bib9a) 2007; 46 Schuchmann (10.1016/j.jorganchem.2019.120878_bib11a) 2009; 48 Yang (10.1016/j.jorganchem.2019.120878_bib38) 2009 Grirrane (10.1016/j.jorganchem.2019.120878_bib2) 2007; 129 Popelier (10.1016/j.jorganchem.2019.120878_bib28e) 2000 Lu (10.1016/j.jorganchem.2019.120878_bib34) 2012; 33 Macchi (10.1016/j.jorganchem.2019.120878_bib45b) 2003; 238–239 Grirrane (10.1016/j.jorganchem.2019.120878_bib5) 2007; 129 Fedushkin (10.1016/j.jorganchem.2019.120878_bib9b) 2009; 28 Freitag (10.1016/j.jorganchem.2019.120878_bib8c) 2013; 42 Ayala (10.1016/j.jorganchem.2019.120878_bib26) 2018; 470 Bader (10.1016/j.jorganchem.2019.120878_bib28c) 1991; 91 Weigend (10.1016/j.jorganchem.2019.120878_bib30b) 2006; 8 Gondzik (10.1016/j.jorganchem.2019.120878_bib44) 2010; 16 Freitag (10.1016/j.jorganchem.2019.120878_bib17c) 2015; 54 Echeverría (10.1016/j.jorganchem.2019.120878_bib22) 2017; 56 Becke (10.1016/j.jorganchem.2019.120878_bib29a) 1988; 38 Stasch (10.1016/j.jorganchem.2019.120878_bib16b) 2012; 18 Xie (10.1016/j.jorganchem.2019.120878_bib20c) 2005; 404 Keith (10.1016/j.jorganchem.2019.120878_bib33) 2012 del Río (10.1016/j.jorganchem.2019.120878_bib4) 2005; 44 Gao (10.1016/j.jorganchem.2019.120878_bib39) 2012; 31 Bader (10.1016/j.jorganchem.2019.120878_bib28a) 1990 Bader (10.1016/j.jorganchem.2019.120878_bib28b) 2005; 136 Kang (10.1016/j.jorganchem.2019.120878_bib20b) 2005; 109 Bollermann (10.1016/j.jorganchem.2019.120878_bib35b) 2011; 30 Philpott (10.1016/j.jorganchem.2019.120878_bib20g) 2006; 327 Perdew (10.1016/j.jorganchem.2019.120878_bib29b) 1986; 33 Carmona (10.1016/j.jorganchem.2019.120878_bib12a) 2008; 47 Xie (10.1016/j.jorganchem.2019.120878_bib20a) 2005; 127 Pandey (10.1016/j.jorganchem.2019.120878_bib20l) 2007; 692 Philpott (10.1016/j.jorganchem.2019.120878_bib20h) 2006; 773 Yu (10.1016/j.jorganchem.2019.120878_bib10b) 2008; 27 Mayer (10.1016/j.jorganchem.2019.120878_bib17b) 2017; 56 Espinosa (10.1016/j.jorganchem.2019.120878_bib47) 2002; 117 Lohrey (10.1016/j.jorganchem.2019.120878_bib18) 2019; 141 Liu (10.1016/j.jorganchem.2019.120878_bib16a) 2009; 28 del Río (10.1016/j.jorganchem.2019.120878_bib7) 2008; 112 Zhu (10.1016/j.jorganchem.2019.120878_bib8b) 2007; 129 Zhu (10.1016/j.jorganchem.2019.120878_bib43) 2009; 28 Gervasio (10.1016/j.jorganchem.2019.120878_bib46) 2004; 387 |
| References_xml | – volume: 7 start-page: 6413 year: 2016 end-page: 6421 ident: bib21 publication-title: Chem. Sci. contributor: fullname: Fischer – volume: B72 start-page: 171 year: 2016 end-page: 179 ident: bib40 publication-title: Acta Crystallogr. contributor: fullname: Ward – start-page: 5773 year: 2009 end-page: 5779 ident: bib38 publication-title: Dalton Trans. contributor: fullname: Wu – volume: 54 start-page: 352 year: 2015 end-page: 358 ident: bib15 publication-title: Inorg. Chem. contributor: fullname: Fischer – volume: 141 start-page: 800 year: 2019 end-page: 804 ident: bib18 publication-title: J. Am. Chem. Soc. contributor: fullname: Arnold – volume: 127 start-page: 2818 year: 2005 end-page: 2819 ident: bib20 publication-title: J. Am. Chem. Soc. contributor: fullname: Kan – volume: 46 start-page: 7757 year: 2010 end-page: 7759 ident: bib41 publication-title: Chem. Commun. contributor: fullname: Harder – volume: B63 start-page: 862 year: 2007 end-page: 868 ident: bib6 publication-title: Acta Crystallogr. contributor: fullname: Weber – volume: 48 start-page: 5748 year: 2009 end-page: 5751 ident: bib14 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Boese – volume: 119 year: 2019 ident: bib23 publication-title: Int. J. Quantum Chem. contributor: fullname: Galindo – volume: 470 start-page: 197 year: 2018 end-page: 205 ident: bib26 publication-title: Inorg. Chim. Acta contributor: fullname: Galindo – year: 2012 ident: bib33 article-title: AIMALL (Version 12.06.05) contributor: fullname: Keith – volume: 46 start-page: 4302 year: 2007 end-page: 4305 ident: bib9 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Ketkov – volume: 48 start-page: 807 year: 2009 end-page: 810 ident: bib11 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Roesky – volume: 7 start-page: 3297 year: 2005 end-page: 3305 ident: bib30 publication-title: Phys. Chem. Chem. Phys. contributor: fullname: Weigend – volume: 305 start-page: 1136 year: 2004 end-page: 1138 ident: bib1 publication-title: Science contributor: fullname: Monge – volume: 41 start-page: 3759 year: 2012 end-page: 3771 ident: bib13 publication-title: Chem. Soc. Rev. contributor: fullname: Roesky – volume: 136 start-page: 819 year: 1990 end-page: 854 ident: bib28 article-title: Atoms in Molecules: A Quantum Theory publication-title: Monatshefte Chem. contributor: fullname: Popelier – volume: 29 start-page: 1174 year: 2010 end-page: 1190 ident: bib36 publication-title: Organometallics contributor: fullname: Mountford – volume: 27 start-page: 1787 year: 2006 end-page: 1799 ident: bib31 publication-title: Comput. Chem. contributor: fullname: Krieg – volume: 28 start-page: 5270 year: 2009 end-page: 5272 ident: bib16 publication-title: Organometallics contributor: fullname: Jones – volume: 127 start-page: 11944 year: 2005 end-page: 11945 ident: bib42 publication-title: J. Am. Chem. Soc. contributor: fullname: Robinson – volume: 117 start-page: 5529 year: 2002 ident: bib47 publication-title: J. Chem. Phys. contributor: fullname: Molins – volume: 305 start-page: 1136 year: 2004 ident: bib3 publication-title: Science contributor: fullname: Monge – volume: 117 start-page: 4657 year: 2013 end-page: 4863 ident: bib24 publication-title: J. Phys. Chem. contributor: fullname: Wang – volume: 56 start-page: 10151 year: 2017 end-page: 10155 ident: bib22 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Alvarez – volume: 28 start-page: 1590 year: 2009 end-page: 1592 ident: bib43 publication-title: Organometallics contributor: fullname: Power – volume: 9 start-page: 8906 year: 2018 end-page: 8913 ident: bib17 publication-title: Chem. Sci. contributor: fullname: Fischer – year: 1989 ident: bib27 article-title: Density Functional Theory of Atoms and Molecules contributor: fullname: Yang – volume: 38 start-page: 3098 year: 1988 end-page: 3100 ident: bib29 publication-title: Phys. Rev. A: Gen. Phys. contributor: fullname: Perdew – year: 2009 ident: bib32 article-title: Gaussian, Inc., Wallingford CT contributor: fullname: Fox – volume: 48 start-page: 1931 year: 2019 end-page: 1935 ident: bib19 publication-title: Dalton Trans. contributor: fullname: Xu – volume: 387 start-page: 481 year: 2004 end-page: 484 ident: bib46 publication-title: Chem. Phys. Lett. contributor: fullname: Marabello – volume: 24 start-page: 422 year: 2003 end-page: 436 ident: bib48 publication-title: J. Comput. Chem. contributor: fullname: Bertini – volume: 129 start-page: 693 year: 2007 ident: bib2 publication-title: J. Am. Chem. Soc. contributor: fullname: Andersen – volume: 44 start-page: 1244 year: 2005 end-page: 1247 ident: bib4 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Carmona – start-page: 2363 year: 2007 end-page: 2365 ident: bib37 publication-title: Chem. Commun. contributor: fullname: Wu – volume: 47 start-page: 6526 year: 2008 end-page: 6536 ident: bib12 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Carmona – volume: 16 start-page: 13599 year: 2010 end-page: 13602 ident: bib44 publication-title: Chem. Eur J. contributor: fullname: Schulz – volume: 50 start-page: 10486 year: 2011 ident: bib35 publication-title: Inorg. Chem. contributor: fullname: Fischer – volume: 112 start-page: 10516 year: 2008 end-page: 10525 ident: bib7 publication-title: J. Phys. Chem. contributor: fullname: Carmona – volume: 129 start-page: 693 year: 2007 end-page: 703 ident: bib5 publication-title: J. Am. Chem. Soc. contributor: fullname: Andersen – volume: 33 start-page: 580 year: 2012 end-page: 592 ident: bib34 publication-title: J. Comput. Chem. contributor: fullname: Chen – volume: 27 start-page: 4125 year: 2007 end-page: 4127 ident: bib10 publication-title: Chem. Commun. contributor: fullname: Wu – volume: 31 start-page: 2978 year: 2012 end-page: 2985 ident: bib39 publication-title: Organometallics contributor: fullname: Yang – volume: 6 start-page: 6331 year: 2015 end-page: 16707 ident: bib25 publication-title: Nat. Commun. contributor: fullname: Zhao – volume: 120 start-page: 13429 year: 1998 end-page: 13435 ident: bib45 publication-title: J. Am. Chem. Soc. contributor: fullname: Sironi – volume: 45 start-page: 5807 year: 2006 end-page: 5810 ident: bib8 publication-title: Angew. Chem. Int. Ed. contributor: fullname: Fischer – volume: 30 start-page: 4123 year: 2011 ident: 10.1016/j.jorganchem.2019.120878_bib35b publication-title: Organometallics doi: 10.1021/om200430t contributor: fullname: Bollermann – volume: 327 start-page: 283 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib20g publication-title: Chem. Phys. doi: 10.1016/j.chemphys.2006.04.021 contributor: fullname: Philpott – volume: 54 start-page: 4370 year: 2015 ident: 10.1016/j.jorganchem.2019.120878_bib17c publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.201410737 contributor: fullname: Freitag – volume: 117 start-page: 4657 year: 2013 ident: 10.1016/j.jorganchem.2019.120878_bib24a publication-title: J. Phys. Chem. doi: 10.1021/jp311683p contributor: fullname: Hepperle – volume: 773 start-page: 43 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib20h publication-title: J. Mol. Struct. doi: 10.1016/j.theochem.2006.06.040 contributor: fullname: Philpott – volume: 44 start-page: 1244 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib4 publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200462175 contributor: fullname: del Río – volume: 252 start-page: 1532 year: 2008 ident: 10.1016/j.jorganchem.2019.120878_bib12b publication-title: Coord. Chem. Rev. doi: 10.1016/j.ccr.2008.01.014 contributor: fullname: Grirrane – volume: 692 start-page: 1058 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib20l publication-title: J. Organomet. Chem. doi: 10.1016/j.jorganchem.2006.10.067 contributor: fullname: Pandey – volume: 7 start-page: 3297 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib30a publication-title: Phys. Chem. Chem. Phys. doi: 10.1039/b508541a contributor: fullname: Weigend – volume: 404 start-page: 212 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib20c publication-title: Chem. Phys. Lett. doi: 10.1016/j.cplett.2005.01.086 contributor: fullname: Xie – volume: 38 start-page: 3098 year: 1988 ident: 10.1016/j.jorganchem.2019.120878_bib29a publication-title: Phys. Rev. A: Gen. Phys. doi: 10.1103/PhysRevA.38.3098 contributor: fullname: Becke – volume: 50 start-page: 772 year: 2011 ident: 10.1016/j.jorganchem.2019.120878_bib35c publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.201005808 contributor: fullname: Bollermann – volume: 9 start-page: 8906 year: 2018 ident: 10.1016/j.jorganchem.2019.120878_bib17a publication-title: Chem. Sci. doi: 10.1039/C8SC03902J contributor: fullname: Banh – volume: 132 year: 2010 ident: 10.1016/j.jorganchem.2019.120878_bib31b publication-title: Chem. Phys. contributor: fullname: Grimme – volume: 29 start-page: 1174 year: 2010 ident: 10.1016/j.jorganchem.2019.120878_bib36 publication-title: Organometallics doi: 10.1021/om901013b contributor: fullname: Cushion – volume: 109 start-page: 4342 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib20b publication-title: J. Phys. Chem. A doi: 10.1021/jp044293k contributor: fullname: Kang – volume: 129 start-page: 693 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib5 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja0668217 contributor: fullname: Grirrane – volume: 112 start-page: 10516 year: 2008 ident: 10.1016/j.jorganchem.2019.120878_bib7 publication-title: J. Phys. Chem. doi: 10.1021/jp805291e contributor: fullname: del Río – volume: 305 start-page: 1136 year: 2004 ident: 10.1016/j.jorganchem.2019.120878_bib1 publication-title: Science doi: 10.1126/science.1101356 contributor: fullname: Resa – volume: 56 year: 2017 ident: 10.1016/j.jorganchem.2019.120878_bib17b publication-title: Angew. Chem. Int. Ed. contributor: fullname: Mayer – volume: B63 start-page: 862 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib6 publication-title: Acta Crystallogr. doi: 10.1107/S0108768107045880 contributor: fullname: van der Maelen – volume: 24 start-page: 3683 year: 2018 ident: 10.1016/j.jorganchem.2019.120878_bib25c publication-title: Chem. Eur J. doi: 10.1002/chem.201705173 contributor: fullname: Hu – volume: 16 start-page: 13599 year: 2010 ident: 10.1016/j.jorganchem.2019.120878_bib44 publication-title: Chem. Eur J. doi: 10.1002/chem.201002482 contributor: fullname: Gondzik – volume: 333 start-page: 201 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib20m publication-title: Chem. Phys. doi: 10.1016/j.chemphys.2007.01.024 contributor: fullname: Philpott – start-page: 2363 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib37 publication-title: Chem. Commun. doi: 10.1039/B703200E contributor: fullname: Yang – volume: 46 start-page: 7757 year: 2010 ident: 10.1016/j.jorganchem.2019.120878_bib41 publication-title: Chem. Commun. doi: 10.1039/c0cc02859b contributor: fullname: Schulz – start-page: 5773 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib38 publication-title: Dalton Trans. doi: 10.1039/b904478g contributor: fullname: Yang – year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib32 contributor: fullname: 01 – volume: 387 start-page: 481 year: 2004 ident: 10.1016/j.jorganchem.2019.120878_bib46 publication-title: Chem. Phys. Lett. doi: 10.1016/j.cplett.2004.02.043 contributor: fullname: Gervasio – volume: 117 start-page: 13161 year: 2013 ident: 10.1016/j.jorganchem.2019.120878_bib24b publication-title: J. Phys. Chem. doi: 10.1021/jp407876a contributor: fullname: Hepperle – year: 1989 ident: 10.1016/j.jorganchem.2019.120878_bib27 contributor: fullname: Parr – volume: 33 start-page: 580 year: 2012 ident: 10.1016/j.jorganchem.2019.120878_bib34 publication-title: J. Comput. Chem. doi: 10.1002/jcc.22885 contributor: fullname: Lu – volume: 54 start-page: 10000 year: 2015 ident: 10.1016/j.jorganchem.2019.120878_bib16c publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.201504818 contributor: fullname: Hicks – volume: 24 start-page: 422 year: 2003 ident: 10.1016/j.jorganchem.2019.120878_bib48 publication-title: J. Comput. Chem. doi: 10.1002/jcc.10205 contributor: fullname: Gatti – volume: 5 start-page: 461 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib20j publication-title: J. Theor. Comput. Chem. doi: 10.1142/S0219633606002398 contributor: fullname: Wang – volume: 50 start-page: 10486 year: 2011 ident: 10.1016/j.jorganchem.2019.120878_bib35a publication-title: Inorg. Chem. doi: 10.1021/ic201701r contributor: fullname: Bollermann – volume: 238–239 start-page: 383 year: 2003 ident: 10.1016/j.jorganchem.2019.120878_bib45b publication-title: Coord. Chem. Rev. doi: 10.1016/S0010-8545(02)00252-7 contributor: fullname: Macchi – volume: 48 start-page: 5748 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib14 publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200902202 contributor: fullname: Schulz – volume: 46 start-page: 4302 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib9a publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200605251 contributor: fullname: Fedushkin – volume: 54 start-page: 352 year: 2015 ident: 10.1016/j.jorganchem.2019.120878_bib15 publication-title: Inorg. Chem. doi: 10.1021/ic502532g contributor: fullname: Freitag – volume: 776 start-page: 113 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib20i publication-title: J. Mol. Struct. doi: 10.1016/j.theochem.2006.08.038 contributor: fullname: Philpott – volume: 127 start-page: 11944 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib42 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja053819r contributor: fullname: Wang – volume: 45 start-page: 5807 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib8a publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200601926 contributor: fullname: Zhu – volume: 47 start-page: 6526 year: 2008 ident: 10.1016/j.jorganchem.2019.120878_bib12a publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200704568 contributor: fullname: Carmona – volume: 27 start-page: 1787 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib31a publication-title: Comput. Chem. doi: 10.1002/jcc.20495 contributor: fullname: Grimme – volume: 7 start-page: 6413 year: 2016 ident: 10.1016/j.jorganchem.2019.120878_bib21 publication-title: Chem. Sci. doi: 10.1039/C6SC02106A contributor: fullname: Freitag – volume: 33 start-page: 8822 year: 1986 ident: 10.1016/j.jorganchem.2019.120878_bib29b publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.33.8822 contributor: fullname: Perdew – volume: 48 start-page: 1931 year: 2019 ident: 10.1016/j.jorganchem.2019.120878_bib19 publication-title: Dalton Trans. doi: 10.1039/C8DT04651D contributor: fullname: Chen – year: 2012 ident: 10.1016/j.jorganchem.2019.120878_bib33 contributor: fullname: Keith – volume: 28 start-page: 3863 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib9b publication-title: Organometallics doi: 10.1021/om900291x contributor: fullname: Fedushkin – volume: 109 start-page: 7757 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib20d publication-title: J. Phys. Chem. A doi: 10.1021/jp051065x contributor: fullname: Kress – volume: 129 start-page: 693 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib2 publication-title: J. Am. Chem. Soc. doi: 10.1021/ja0668217 contributor: fullname: Grirrane – volume: 805 start-page: 127 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib20n publication-title: J. Mol. Struct. doi: 10.1016/j.theochem.2006.11.007 contributor: fullname: Kan – volume: 136 start-page: 819 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib28b publication-title: Monatshefte Chem. doi: 10.1007/s00706-005-0307-x contributor: fullname: Bader – volume: 117 start-page: 5529 year: 2002 ident: 10.1016/j.jorganchem.2019.120878_bib47 publication-title: J. Chem. Phys. doi: 10.1063/1.1501133 contributor: fullname: Espinosa – volume: 129 start-page: 10847 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib8b publication-title: J. Am. Chem. Soc. doi: 10.1021/ja072682x contributor: fullname: Zhu – volume: 119 year: 2019 ident: 10.1016/j.jorganchem.2019.120878_bib23 publication-title: Int. J. Quantum Chem. doi: 10.1002/qua.25823 contributor: fullname: Ayala – volume: 24 start-page: 16702 year: 2018 ident: 10.1016/j.jorganchem.2019.120878_bib25b publication-title: Chem. Eur J. doi: 10.1002/chem.201801227 contributor: fullname: Hu – volume: 42 start-page: 10540 year: 2013 ident: 10.1016/j.jorganchem.2019.120878_bib8c publication-title: Dalton Trans. doi: 10.1039/c3dt51230d contributor: fullname: Freitag – volume: 470 start-page: 197 year: 2018 ident: 10.1016/j.jorganchem.2019.120878_bib26 publication-title: Inorg. Chim. Acta doi: 10.1016/j.ica.2017.06.008 contributor: fullname: Ayala – year: 1990 ident: 10.1016/j.jorganchem.2019.120878_bib28a contributor: fullname: Bader – volume: 28 start-page: 5270 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib16a publication-title: Organometallics doi: 10.1021/om900408a contributor: fullname: Liu – start-page: 4125 year: 2007 ident: 10.1016/j.jorganchem.2019.120878_bib10a publication-title: Chem. Commun. doi: 10.1039/b707396h contributor: fullname: Tsai – volume: 31 start-page: 2978 year: 2012 ident: 10.1016/j.jorganchem.2019.120878_bib39 publication-title: Organometallics doi: 10.1021/om200868j contributor: fullname: Gao – volume: 48 start-page: 807 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib11a publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.200803736 contributor: fullname: Schuchmann – volume: 8 start-page: 1057 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib30b publication-title: Phys. Chem. Chem. Phys. doi: 10.1039/b515623h contributor: fullname: Weigend – volume: 305 start-page: 1136 year: 2004 ident: 10.1016/j.jorganchem.2019.120878_bib3 publication-title: Science doi: 10.1126/science.1101356 contributor: fullname: Resa – volume: 249 start-page: 633 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib28d publication-title: Coord. Chem. Rev. doi: 10.1016/j.ccr.2004.08.022 contributor: fullname: Cortés-Guzmán – volume: 18 start-page: 15105 year: 2012 ident: 10.1016/j.jorganchem.2019.120878_bib16b publication-title: Chem. Eur J. doi: 10.1002/chem.201202560 contributor: fullname: Stasch – volume: 758 start-page: 127 year: 2006 ident: 10.1016/j.jorganchem.2019.120878_bib20f publication-title: J. Mol. Struct. doi: 10.1016/j.theochem.2005.10.025 contributor: fullname: Liu – volume: 28 start-page: 1590 year: 2009 ident: 10.1016/j.jorganchem.2019.120878_bib43 publication-title: Organometallics doi: 10.1021/om801155j contributor: fullname: Zhu – volume: 91 start-page: 893 year: 1991 ident: 10.1016/j.jorganchem.2019.120878_bib28c publication-title: Chem. Rev. doi: 10.1021/cr00005a013 contributor: fullname: Bader – volume: B72 start-page: 171 year: 2016 ident: 10.1016/j.jorganchem.2019.120878_bib40 publication-title: Acta Crystallogr. contributor: fullname: Bruno – volume: 415 start-page: 141 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib20e publication-title: Chem. Phys. Lett. doi: 10.1016/j.cplett.2005.08.122 contributor: fullname: Richardson – volume: 56 start-page: 10151 year: 2017 ident: 10.1016/j.jorganchem.2019.120878_bib22 publication-title: Angew. Chem. Int. Ed. doi: 10.1002/anie.201702171 contributor: fullname: Echeverría – year: 2000 ident: 10.1016/j.jorganchem.2019.120878_bib28e contributor: fullname: Popelier – volume: 120 start-page: 13429 year: 1998 ident: 10.1016/j.jorganchem.2019.120878_bib45a publication-title: J. Am. Chem. Soc. doi: 10.1021/ja982903m contributor: fullname: Macchi – volume: 27 start-page: 5800 year: 2008 ident: 10.1016/j.jorganchem.2019.120878_bib10b publication-title: Organometallics doi: 10.1021/om800405m contributor: fullname: Yu – volume: 127 start-page: 2818 year: 2005 ident: 10.1016/j.jorganchem.2019.120878_bib20a publication-title: J. Am. Chem. Soc. doi: 10.1021/ja042754+ contributor: fullname: Xie – volume: 141 start-page: 800 year: 2019 ident: 10.1016/j.jorganchem.2019.120878_bib18 publication-title: J. Am. Chem. Soc. doi: 10.1021/jacs.8b12494 contributor: fullname: Lohrey – volume: 41 start-page: 3759 year: 2012 ident: 10.1016/j.jorganchem.2019.120878_bib13 publication-title: Chem. Soc. Rev. doi: 10.1039/c2cs15343b contributor: fullname: Li – volume: 17 start-page: 1773 year: 2011 ident: 10.1016/j.jorganchem.2019.120878_bib11b publication-title: Chem. Eur J. doi: 10.1002/chem.201002443 contributor: fullname: Nayek – volume: 6 start-page: 6331 year: 2015 ident: 10.1016/j.jorganchem.2019.120878_bib25a publication-title: Nat. Commun. doi: 10.1038/ncomms7331 contributor: fullname: Cui |
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| Snippet | Several [Zn2L2] and [CpZn2Ln] dizinc compounds have been studied by density functional theory (DFT) and quantum theory of atoms in molecules (QTAIM) in order... |
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| SubjectTerms | Cyclopentadienyl DFT Dizinc Organometallic complexes QTAIM Zinc |
| Title | A QTAIM and DFT study of the dizinc bond in non-symmetric [CpZn2Ln] complexes |
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