Crystallography Open Database

Information card for entry 1508501

Preview

Coordinates	1508501.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bismuthethandisulfonato
Formula	C3 H10 Bi O11 S3
Calculated formula	C3 H10 Bi O11 S3
Title of publication	An Unusual Bismuth Ethanedisulfonate Network
Authors of publication	Gschwind, Fabienne; Jansen, Martin
Journal of publication	Crystals
Year of publication	2012
Journal volume	2
Journal issue	4
Pages of publication	1374 - 1381
a	11.601 ± 0.002 Å
b	10.39 ± 0.002 Å
c	10.498 ± 0.002 Å
α	90°
β	115.15 ± 0.03°
γ	90°
Cell volume	1145.4 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0386
Residual factor for significantly intense reflections	0.0283
Weighted residual factors for significantly intense reflections	0.0475
Weighted residual factors for all reflections included in the refinement	0.0492
Goodness-of-fit parameter for all reflections included in the refinement	1.124
Diffraction radiation probe	x-ray
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1508501.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1508501.cif
86240	2013-05-15	cif/1/50/85/ (saulius@koala.ibt.lt) Fixing bibliography in 1508501.cif (bug http://bugz.crystallography.net/bugzilla3/show_bug.cgi?id=7).	1508501.cif
69367	2012-12-13	cif/ Adding structures of 1508501 via cif-deposit CGI script.	1508501.cif