Crystallography Open Database

Information card for entry 7014028

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Coordinates	7014028.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Bis(1,2-bis(dimethylstibanylmethyl)benzene)copper(I) tetrafluoroborate ethanol solvate, dichloromethane solvate
Formula	C27.4 H48.4 B Cl0.4 Cu F4 O0.8 Sb4
Calculated formula	C27.184 H47.96 B Cl0.408 Cu F4 O0.796 Sb4
Title of publication	Synthesis and characterisation of transition metal halide complexes of the xylyl-distibine, 1,2-bis(dimethylstibanylmethyl)benzene.
Authors of publication	Levason, William; Matthews, Melissa L.; Reid, Gillian; Webster, Michael
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2004
Journal issue	4
Pages of publication	554 - 561
a	14.6315 ± 0.001 Å
b	18.5261 ± 0.001 Å
c	14.2015 ± 0.001 Å
α	90°
β	106.83 ± 0.003°
γ	90°
Cell volume	3684.6 ± 0.4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	8
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	0.0354
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0735
Weighted residual factors for all reflections included in the refinement	0.076
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7014028.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7014028.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7014028.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7014028.cif