Efficient purification of ethene by an ethane-trapping metal-organic framework

Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by trapping the inert C 2 H 6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1...

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Published in	Nature communications Vol. 6; no. 1; p. 8697
Main Authors	Liao, Pei-Qin, Zhang, Wei-Xiong, Zhang, Jie-Peng, Chen, Xiao-Ming
Format	Journal Article
Language	English
Published	London Nature Publishing Group UK 29.10.2015 Nature Publishing Group
Subjects	119/118 639/301/299/921 639/638/263 Adsorbents Adsorption Computer simulation Design Electronegativity Electropositivity Energy consumption Ethane Ethylene Functional groups Gas mixtures Gases Humanities and Social Sciences Hydrogen bonds Ligands Materials selection Metal-organic frameworks Monte Carlo simulation multidisciplinary Natural gas Nitrogen Physical properties Polymerization Porous materials Purity Science Science (multidisciplinary) Selectivity Single crystals Trapping X-ray diffraction
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Abstract	Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by trapping the inert C 2 H 6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C 2 H 4 /C 2 H 6 ) through 1 litre of this C 2 H 6 selective adsorbent directly produces 56 litres of C 2 H 4 with 99.95%+ purity (required by the C 2 H 4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C 2 H 6 selective materials can only produce ca . ⩽ litre, and conventional C 2 H 4 selective adsorbents require at least four adsorption–desorption cycles to achieve the same C 2 H 4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C 2 H 6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C–H···N hydrogen bonds with C 2 H 6 instead of the more polar competitor C 2 H 4 . The separation of high purity ethene from the mixed gaseous products of cracking poses significant obstacles. Here, the authors present a metal-organic framework which, in contrast to most absorbents, selectively binds the less polar ethane thus allowing the efficient collection of the target product.
AbstractList	Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by trapping the inert C 2 H 6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C 2 H 4 /C 2 H 6 ) through 1 litre of this C 2 H 6 selective adsorbent directly produces 56 litres of C 2 H 4 with 99.95%+ purity (required by the C 2 H 4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C 2 H 6 selective materials can only produce ca . ⩽ litre, and conventional C 2 H 4 selective adsorbents require at least four adsorption–desorption cycles to achieve the same C 2 H 4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C 2 H 6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C–H···N hydrogen bonds with C 2 H 6 instead of the more polar competitor C 2 H 4 . The separation of high purity ethene from the mixed gaseous products of cracking poses significant obstacles. Here, the authors present a metal-organic framework which, in contrast to most absorbents, selectively binds the less polar ethane thus allowing the efficient collection of the target product. Separating ethene (C2H4) from ethane (C2H6) is of paramount importance and difficulty. Here we show that C2H4 can be efficiently purified by trapping the inert C2H6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C2H4/C2H6) through 1 litre of this C2H6 selective adsorbent directly produces 56 litres of C2H4 with 99.95%+ purity (required by the C2H4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C2H6 selective materials can only produce ca. ⩽ litre, and conventional C2H4 selective adsorbents require at least four adsorption-desorption cycles to achieve the same C2H4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C2H6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C-H···N hydrogen bonds with C2H6 instead of the more polar competitor C2H4.Separating ethene (C2H4) from ethane (C2H6) is of paramount importance and difficulty. Here we show that C2H4 can be efficiently purified by trapping the inert C2H6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C2H4/C2H6) through 1 litre of this C2H6 selective adsorbent directly produces 56 litres of C2H4 with 99.95%+ purity (required by the C2H4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C2H6 selective materials can only produce ca. ⩽ litre, and conventional C2H4 selective adsorbents require at least four adsorption-desorption cycles to achieve the same C2H4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C2H6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C-H···N hydrogen bonds with C2H6 instead of the more polar competitor C2H4. Separating ethene (C2H4) from ethane (C2H6) is of paramount importance and difficulty. Here we show that C2H4 can be efficiently purified by trapping the inert C2H6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C2H4/C2H6) through 1 litre of this C2H6 selective adsorbent directly produces 56 litres of C2H4 with 99.95%+ purity (required by the C2H4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C2H6 selective materials can only produce ca. ⩽ litre, and conventional C2H4 selective adsorbents require at least four adsorption-desorption cycles to achieve the same C2H4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C2H6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C-H···N hydrogen bonds with C2H6 instead of the more polar competitor C2H4. Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by trapping the inert C 2 H 6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C 2 H 4 /C 2 H 6 ) through 1 litre of this C 2 H 6 selective adsorbent directly produces 56 litres of C 2 H 4 with 99.95%+ purity (required by the C 2 H 4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C 2 H 6 selective materials can only produce ca . ⩽ litre, and conventional C 2 H 4 selective adsorbents require at least four adsorption–desorption cycles to achieve the same C 2 H 4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C 2 H 6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C–H···N hydrogen bonds with C 2 H 6 instead of the more polar competitor C 2 H 4 . The separation of high purity ethene from the mixed gaseous products of cracking poses significant obstacles. Here, the authors present a metal-organic framework which, in contrast to most absorbents, selectively binds the less polar ethane thus allowing the efficient collection of the target product. Separating ethene (C2 H4 ) from ethane (C2 H6 ) is of paramount importance and difficulty. Here we show that C2 H4 can be efficiently purified by trapping the inert C2 H6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C2 H4 /C2 H6 ) through 1 litre of this C2 H6 selective adsorbent directly produces 56 litres of C2 H4 with 99.95%+ purity (required by the C2 H4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C2 H6 selective materials can only produce ca. [els] litre, and conventional C2 H4 selective adsorbents require at least four adsorption-desorption cycles to achieve the same C2 H4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C2 H6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C-H···N hydrogen bonds with C2 H6 instead of the more polar competitor C2 H4 . Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by trapping the inert C 2 H 6 in a judiciously designed metal-organic framework. Under ambient conditions, passing a typical cracked gas mixture (15:1 C 2 H 4 /C 2 H 6 ) through 1 litre of this C 2 H 6 selective adsorbent directly produces 56 litres of C 2 H 4 with 99.95%+ purity (required by the C 2 H 4 polymerization reactor) at the outlet, with a single breakthrough operation, while other C 2 H 6 selective materials can only produce ca . ⩽ litre, and conventional C 2 H 4 selective adsorbents require at least four adsorption–desorption cycles to achieve the same C 2 H 4 purity. Single-crystal X-ray diffraction and computational simulation studies showed that the exceptional C 2 H 6 selectivity arises from the proper positioning of multiple electronegative and electropositive functional groups on the ultramicroporous pore surface, which form multiple C–H···N hydrogen bonds with C 2 H 6 instead of the more polar competitor C 2 H 4 .
ArticleNumber	8697
Author	Chen, Xiao-Ming Zhang, Jie-Peng Liao, Pei-Qin Zhang, Wei-Xiong
Author_xml	– sequence: 1 givenname: Pei-Qin surname: Liao fullname: Liao, Pei-Qin organization: MOE Key Laboratory of Bioinorganic and Synthetic Chemistry, School of Chemistry and Chemical Engineering, Sun Yat-Sen University – sequence: 2 givenname: Wei-Xiong surname: Zhang fullname: Zhang, Wei-Xiong organization: MOE Key Laboratory of Bioinorganic and Synthetic Chemistry, School of Chemistry and Chemical Engineering, Sun Yat-Sen University – sequence: 3 givenname: Jie-Peng surname: Zhang fullname: Zhang, Jie-Peng email: zhangjp7@mail.sysu.edu.cn organization: MOE Key Laboratory of Bioinorganic and Synthetic Chemistry, School of Chemistry and Chemical Engineering, Sun Yat-Sen University – sequence: 4 givenname: Xiao-Ming surname: Chen fullname: Chen, Xiao-Ming organization: MOE Key Laboratory of Bioinorganic and Synthetic Chemistry, School of Chemistry and Chemical Engineering, Sun Yat-Sen University
BackLink	https://www.ncbi.nlm.nih.gov/pubmed/26510376$$D View this record in MEDLINE/PubMed
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References	DenysenkoDGrzywaMJelicJReuterKVolkmerDScorpionate-type coordination in MFU-4l metal–organic frameworks: small-molecule binding and activation upon the thermally activated formation of open metal sitesAngew. Chem. Int. Ed.201453583258361:CAS:528:DC%2BC2cXot1Smsbw%3D10.1002/anie.201310004 van den BerghJUnderstanding the anomalous alkane selectivity of ZIF-7 in the separation of light alkane/alkene mixturesChem. Eur. J.201117883288401:CAS:528:DC%2BC3MXoslCktL4%3D10.1002/chem.201100958 LiaoP-QMonodentate hydroxide as a super strong yet reversible active site for CO2 capture from high-humidity flue gasEnergy Environ. Sci.20158101110161:CAS:528:DC%2BC2MXjtVKmug%3D%3D10.1039/C4EE02717E HermZRBlochEDLongJ RHydrocarbon separations in metal–organic frameworksChem. 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Snippet	Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by... Separating ethene (C2H4) from ethane (C2H6) is of paramount importance and difficulty. Here we show that C2H4 can be efficiently purified by trapping the inert... Separating ethene (C2 H4 ) from ethane (C2 H6 ) is of paramount importance and difficulty. Here we show that C2 H4 can be efficiently purified by trapping the... Separating ethene (C 2 H 4 ) from ethane (C 2 H 6 ) is of paramount importance and difficulty. Here we show that C 2 H 4 can be efficiently purified by...
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SubjectTerms	119/118 639/301/299/921 639/638/263 Adsorbents Adsorption Computer simulation Design Electronegativity Electropositivity Energy consumption Ethane Ethylene Functional groups Gas mixtures Gases Humanities and Social Sciences Hydrogen bonds Ligands Materials selection Metal-organic frameworks Monte Carlo simulation multidisciplinary Natural gas Nitrogen Physical properties Polymerization Porous materials Purity Science Science (multidisciplinary) Selectivity Single crystals Trapping X-ray diffraction
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Title	Efficient purification of ethene by an ethane-trapping metal-organic framework
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