Crystallography Open Database

Information card for entry 4123151

Preview

Coordinates	4123151.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H43 P3 Si W
Calculated formula	C21 H43 P3 Si W
SMILES	[WH5]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[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	9.5594 ± 0.0007 Å
b	9.4055 ± 0.0007 Å
c	29.378 ± 0.002 Å
α	90°
β	91.234 ± 0.001°
γ	90°
Cell volume	2640.8 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0487
Residual factor for significantly intense reflections	0.0382
Weighted residual factors for significantly intense reflections	0.0696
Weighted residual factors for all reflections included in the refinement	0.0724
Goodness-of-fit parameter for all reflections included in the refinement	1.154
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.	4123151.cif
128942	2014-12-21	cif/ Adding structures of 4123151 via cif-deposit CGI script.	4123151.cif