Crystallography Open Database

Information card for entry 4123153

Preview

Coordinates	4123153.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H52 P4 Si2 W
Calculated formula	C24 H52 P4 Si2 W
SMILES	[WH3]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[SiH2][SiH](c1ccccc1)c1ccccc1
Title of publication	σ-Silane, Disilanyl, and [W(μ-H)Si(μ-H)W] Bridging Silylene Complexes via the Reactions of W(PMe3)4(η(2)-CH2PMe2)H with Phenylsilanes.
Authors of publication	Zuzek, Ashley A.; Neary, Michelle C.; Parkin, Gerard
Journal of publication	Journal of the American Chemical Society
Year of publication	2014
Pages of publication	141217070549000
a	9.7561 ± 0.0009 Å
b	16.1203 ± 0.0015 Å
c	10.2677 ± 0.001 Å
α	90°
β	93.0754 ± 0.0013°
γ	90°
Cell volume	1612.5 ± 0.3 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 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	0.0314
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0586
Weighted residual factors for all reflections included in the refinement	0.0604
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
179033 (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 4/12/31.	4123153.cif
128944	2014-12-21	cif/ Adding structures of 4123153 via cif-deposit CGI script.	4123153.cif