Crystallography Open Database

Information card for entry 4069701

Preview

Coordinates	4069701.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H73 Li4 N2 O P4 S2 Si2
Calculated formula	C63 H73 Li4 N2 O P4 S2 Si2
Title of publication	Synthesis and Structure of [Li2C(PPh2═NSiMe3)(PPh2═S)]: A Geminal Dianionic Ligand
Authors of publication	Chen, Jun-Hui; Guo, Jiayi; Li, Yongxin; So, Cheuk-Wai
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	15
Pages of publication	4617
a	41.092 ± 0.002 Å
b	12.5386 ± 0.0005 Å
c	27.4618 ± 0.0014 Å
α	90°
β	114.819 ± 0.003°
γ	90°
Cell volume	12842.5 ± 1.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
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	0.1522
Residual factor for significantly intense reflections	0.0674
Weighted residual factors for significantly intense reflections	0.1723
Weighted residual factors for all reflections included in the refinement	0.2477
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178586 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/97.	4069701.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4069701.cif
40399	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4069701, 4069702, 4069703 via cif-deposit CGI script.	4069701.cif