Crystallography Open Database

Information card for entry 4303991

Preview

Coordinates	4303991.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H44 Ge O5 P2 Si4 W
Calculated formula	C23 H44 Ge O5 P2 Si4 W
SMILES	[W]([P]1C(=P[Ge](C=1C)(C([Si](C)(C)C)[Si](C)(C)C)C([Si](C)(C)C)[Si](C)(C)C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
Title of publication	Unusual Reactivity of Methylphosphaalkyne (P\τbCMe) toward Digermenes and Distannenes: Stepwise Formations of Bridged 2,3,5,6-Tetraphospha-1,4-dimethylidenecyclohexanes
Authors of publication	Cameron Jones; Christian Schulten; Andreas Stasch
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	1273 - 1278
a	9.836 ± 0.002 Å
b	11.78 ± 0.002 Å
c	16.021 ± 0.003 Å
α	99.46 ± 0.03°
β	100.06 ± 0.03°
γ	100.66 ± 0.03°
Cell volume	1758.7 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0257
Residual factor for significantly intense reflections	0.0233
Weighted residual factors for significantly intense reflections	0.0502
Weighted residual factors for all reflections included in the refinement	0.0513
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
179077 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/39.	4303991.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303991.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303991.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4303991.cif