Crystallography Open Database

Information card for entry 4334661

Preview

Coordinates	4334661.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H16 Cl4 P2 Si
Calculated formula	C6 H16 Cl4 P2 Si
SMILES	[Si]1(Cl)(Cl)(Cl)(Cl)[P](C)(C)CC[P]1(C)C
Title of publication	Phosphine and Diphosphine Complexes of Silicon(IV) Halides
Authors of publication	William Levason; David Pugh; Gillian Reid
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	5185 - 5193
a	15.603 ± 0.005 Å
b	7.912 ± 0.005 Å
c	11.574 ± 0.005 Å
α	90 ± 0.005°
β	90 ± 0.005°
γ	90 ± 0.005°
Cell volume	1428.8 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0631
Residual factor for significantly intense reflections	0.0559
Weighted residual factors for significantly intense reflections	0.0723
Weighted residual factors for all reflections included in the refinement	0.0746
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179449 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/46.	4334661.cif
100531	2014-02-06	cif/ Adding structures of 4334661 via cif-deposit CGI script.	4334661.cif