Crystallography Open Database

Information card for entry 1520549

1520548 << 1520549 >> 1520550

Preview

Coordinates	1520549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H28 Br10 N2 Te2
Calculated formula	C18 Br10 N2 Te2
SMILES	[Te]1(Br)(Br)(Br)(Br)[Br][Te](Br)(Br)(Br)(Br)[Br]1.[N+](C)(C)(c1ccccc1)C.[N+](C)(C)(C)c1ccccc1
Title of publication	Reaction of TeBr4 with SbBr3 in the Presence of [C6H5(CH3)3N]Br: Crystal Structures of [C6H5(CH3)3N]2[Te2Br10] and [C6H5(CH3)3N][SbTeOBr6]
Authors of publication	Hauge, Sverre; Janickis, Vitalijus; Maroy, Kjartan
Journal of publication	Acta Chemica Scandinavica
Year of publication	1999
Journal volume	53
Pages of publication	992 - 996
a	8.354 ± 0.002 Å
b	11.683 ± 0.003 Å
c	17.753 ± 0.004 Å
α	90°
β	99.52 ± 0.03°
γ	90°
Cell volume	1708.8 ± 0.7 Å³
Ambient diffraction temperature	263 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.074
Weighted residual factors for significantly intense reflections	0.1725
Goodness-of-fit parameter for all reflections included in the refinement	0.946
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520549.cif
139287	2015-06-17	cif/ Adding structures of 1520549 via cif-deposit CGI script.	1520549.cif