Crystallography Open Database

Information card for entry 4307232

Preview

Coordinates	4307232.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl6 O16 Th2
Calculated formula	Cl6 H30 O16 Th2
SMILES	[OH2][Th]1([OH2])([OH2])([OH2])([OH2])([OH][Th]([OH2])([OH2])([OH2])([OH]1)([OH2])([OH2])([OH2])Cl)([OH2])Cl.O.[Cl-].[Cl-].O.[Cl-].[Cl-]
Title of publication	Structures of Dimeric Hydrolysis Products of Thorium
Authors of publication	Richard E. Wilson; S. Skanthakumar; Ginger Sigmon; Peter C. Burns; L. Soderholm
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	2368 - 2372
a	8.09 ± 0.0016 Å
b	8.88 ± 0.0018 Å
c	9.0028 ± 0.0018 Å
α	97.29 ± 0.03°
β	91.07 ± 0.03°
γ	116.57 ± 0.03°
Cell volume	571.7 ± 0.3 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1502
Weighted residual factors for all reflections included in the refinement	0.1516
Goodness-of-fit parameter for all reflections included in the refinement	1.232
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
189301 (current)	2016-12-21	cif/4/30/ (antanas@echidna.ibt.lt) Marking attached hydrogen atoms in entries 4307232, 4307233, 4307234.	4307232.cif
179110	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/72.	4307232.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307232.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307232.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307232.cif