Crystallography Open Database

Information card for entry 4122600

Preview

Coordinates	4122600.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H38 Co P2 Si2
Calculated formula	C14 H38 Co P2 Si2
SMILES	C([Si](C)(C)C)[Co]1(C[Si](C)(C)C)[P](C)(C)CC[P]1(C)C
Title of publication	Bis(phosphine)cobalt dialkyl complexes for directed catalytic alkene hydrogenation.
Authors of publication	Friedfeld, Max R.; Margulieux, Grant W.; Schaefer, Brian A.; Chirik, Paul J.
Journal of publication	Journal of the American Chemical Society
Year of publication	2014
Journal volume	136
Journal issue	38
Pages of publication	13178 - 13181
a	16.251 ± 0.0014 Å
b	10.3659 ± 0.0009 Å
c	12.8209 ± 0.0011 Å
α	90°
β	92.811 ± 0.002°
γ	90°
Cell volume	2157.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0234
Residual factor for significantly intense reflections	0.0206
Weighted residual factors for significantly intense reflections	0.0589
Weighted residual factors for all reflections included in the refinement	0.0729
Goodness-of-fit parameter for all reflections included in the refinement	1.228
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
179028 (current)	2016-03-22	cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/26.	4122600.cif
127001	2014-11-12	cif/ Updating files of 4122598, 4122599, 4122600, 4122601, 4122602 Original log message: Adding full bibliography for 4122598--4122602.cif.	4122600.cif
123708	2014-09-11	cif/ Adding structures of 4122598, 4122599, 4122600, 4122601, 4122602 via cif-deposit CGI script.	4122600.cif