Crystallography Open Database

Information card for entry 2238897

Preview

Coordinates	2238897.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>catena</i>-Poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylendiammonium [[tetrabromidoantimonate(III)]-μ-bromido] hemihydrate]
Formula	C12 H38 Br10 N4 O Sb2
Calculated formula	C12 H38 Br10 N4 O Sb2
Title of publication	<i>catena</i>-Poly[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylendiammonium [[tetrabromidoantimonate(III)]-μ-bromido] hemihydrate]
Authors of publication	Kharrat, Houda; Kamoun, Slaheddine; Michaud, François
Journal of publication	Acta Crystallographica Section E
Year of publication	2013
Journal volume	69
Journal issue	12
Pages of publication	m637 - m638
a	18.086 ± 0.0004 Å
b	19.1755 ± 0.0004 Å
c	19.4619 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	6749.5 ± 0.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1261
Residual factor for significantly intense reflections	0.0473
Weighted residual factors for significantly intense reflections	0.0748
Weighted residual factors for all reflections included in the refinement	0.089
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176798 (current)	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2238897.cif
92275	2014-01-12	cif/ Adding structures of 2238897 via cif-deposit CGI script.	2238897.cif