Tetrahedrally Coordinated sp3‑Hybridized Carbon in Sr2CO4 Orthocarbonate at Ambient Conditions

We have synthesized the orthocarbonate Sr2CO4, in which carbon is tetrahedrally coordinated by four oxygen atoms, at moderately high pressures [20(1) GPa] and high temperatures (≈3500 K) in a diamond anvil cell by reacting a SrCO3 single crystal with SrO powder. We show by synchrotron powder X-ray d...

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Published inInorganic chemistry Vol. 60; no. 8; pp. 5419 - 5422
Main Authors Spahr, Dominik, Binck, Jannes, Bayarjargal, Lkhamsuren, Luchitskaia, Rita, Morgenroth, Wolfgang, Comboni, Davide, Milman, Victor, Winkler, Björn
Format Journal Article
LanguageEnglish
Published American Chemical Society 19.04.2021
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Summary:We have synthesized the orthocarbonate Sr2CO4, in which carbon is tetrahedrally coordinated by four oxygen atoms, at moderately high pressures [20(1) GPa] and high temperatures (≈3500 K) in a diamond anvil cell by reacting a SrCO3 single crystal with SrO powder. We show by synchrotron powder X-ray diffraction, Raman spectroscopy, and density functional thoery calculations that this phase, and hence sp3-hybridized carbon in a CO4 4– group, can be recovered at ambient conditions. The C–O bond distances are all of similar lengths [≈1.41(1) Å], and the O–C–O angles deviate from the ideal tetrahedral angle by a few degrees only.
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content type line 23
ISSN:0020-1669
1520-510X
DOI:10.1021/acs.inorgchem.1c00159