Crystallography Open Database

Information card for entry 1100078

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Coordinates	1100078.cif
External links	AMCSD

Structure parameters

Chemical name	Magnesium thiosulfate hexahydrate
Formula	H12 Mg O9 S2
Calculated formula	H12 Mg O9 S2
SMILES	[Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].S(=S)(=O)([O-])[O-]
Title of publication	Deformation Density in Complex Anions. IV. Magnesium Thiosulfate Hexahydrate, Mg S~2~ O~3~ * 6H2 O
Authors of publication	Elerman, Y; Bats, J W; Fuess, H
Journal of publication	Acta Crystallographica C (39,1983-)
Year of publication	1983
Journal volume	39
Pages of publication	515 - 518
a	9.324 ± 0.002 Å
b	14.461 ± 0.004 Å
c	6.862 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	925.2 Å³
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
130149 (current)	2015-01-27	cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command.	1100078.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	1100078.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	1100078.cif
19	2008-01-26	Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif \| xargs perl -i -pe 's/\r\n/\n/'	1100078.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	1100078.cif
13	2008-01-13	Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory.	1100078.cif
1	2007-11-30	Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29)	1100078.cif