Crystallography Open Database

Information card for entry 4320631

4320630 << 4320631 >> 4320632

Preview

Coordinates	4320631.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H36 Cl3 O18 S6 Tl
Calculated formula	C12 H36 Cl2.918 O18.002 S6 Tl
Title of publication	Structure of the Dimethyl Sulfoxide Solvated Thallium(III) Ion in Solution and in the Solid State
Authors of publication	Guibin Ma; Alireza Molla-Abbassi; Mikael Kritikos; Andrey Ilyukhin; Farideh Jalilehvand; Vadim Kessler; Mikhail Skripkin; Magnus Sandström; Julius Glaser; Jan Näslund; Ingmar Persson
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	6432 - 6438
a	11.8995 ± 0.0009 Å
b	11.8995 ± 0.0009 Å
c	20.467 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	2509.8 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0338
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.0678
Weighted residual factors for all reflections included in the refinement	0.0854
Goodness-of-fit parameter for all reflections included in the refinement	1.208
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
179309 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/06.	4320631.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4320631.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4320631.cif
17827	2011-04-10	../uploads/cif-deposit/cod/cif Adding structures of 4320631 via cif-deposit CGI script.	4320631.cif