Crystallography Open Database

Information card for entry 7110657

Preview

Coordinates	7110657.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H36 Br6 Sb6
Calculated formula	C12 H36 Br6 Sb6
SMILES	C[Sb](C)[Sb+](C)(C)C.C[Sb](C)[Sb+](C)(C)C.C[Sb]1(Br)(Br)[Br][Sb](C)(Br)(Br)[Br]1
Title of publication	Crystal structure of [Me3Sb‒SbMe2]2[(MeSbBr3)2], a trimethylstibine adduct of the dimethylstibenium ion or a stibinostibonium salt?
Authors of publication	Althaus, Henrik; Breunig, Hans J.; Lork, Enno
Journal of publication	Chemical Communications
Year of publication	1999
Journal issue	19
Pages of publication	1971
a	11.894 ± 0.002 Å
b	7.711 ± 0.002 Å
c	19.067 ± 0.005 Å
α	90°
β	107.06 ± 0.02°
γ	90°
Cell volume	1671.8 ± 0.7 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0704
Residual factor for significantly intense reflections	0.0522
Weighted residual factors for significantly intense reflections	0.1287
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
180220 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/06.	7110657.cif
95671	2014-01-28	cif/ Adding structures of 7110657 via cif-deposit CGI script.	7110657.cif