Crystallography Open Database

Information card for entry 4519177

4519176 << 4519177 >> 4519178

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Coordinates	4519177.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H44 Co P3 Si
Calculated formula	C27 H44 Co P3 Si
SMILES	[CoH2]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Implication of a Silyl Cobalt Dihydride Complex as a Useful Catalyst for the Hydrosilylation of Imines
Authors of publication	Bories, Cassandre C.; Barbazanges, Marion; Derat, Etienne; Petit, Marc
Journal of publication	ACS Catalysis
Year of publication	2021
Journal volume	11
Journal issue	22
Pages of publication	14262 - 14273
a	9.0544 ± 0.0005 Å
b	18.8627 ± 0.001 Å
c	9.465 ± 0.0005 Å
α	90°
β	115.243 ± 0.003°
γ	90°
Cell volume	1462.16 ± 0.14 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0375
Residual factor for significantly intense reflections	0.0301
Weighted residual factors for significantly intense reflections	0.0617
Weighted residual factors for all reflections included in the refinement	0.0639
Goodness-of-fit parameter for all reflections included in the refinement	1.015
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
271043 (current)	2021-12-03	cif/ Adding structures of 4519177 via cif-deposit CGI script.	4519177.cif