Crystallography Open Database

Information card for entry 2002787

2002786 << 2002787 >> 2002788

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Coordinates	2002787.cif

Structure parameters

Chemical name	Sodium tribarium iridate(V)
Formula	Ba3 Ir Na O6
Calculated formula	Ba3 Ir Na O6
SMILES	[O-][Ir]([O-])([O-])([O-])([O-])[O-].[Na+].[Ba+2].[Ba+2].[Ba+2]
Title of publication	Ueber Na Ba3 Ru O6 und Na Ba3 Ir O6. Zwei EdelmetallOxometallate mit Sr4 Pt O6-Struktur
Authors of publication	Frenzen, S; Mueller-Buschbaum, Hk
Journal of publication	Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)
Year of publication	1996
Journal volume	51
Pages of publication	1204 - 1206
a	10.1282 ± 0.0014 Å
b	10.1282 ± 0.0014 Å
c	11.905 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	1057.6 Å³
Number of distinct elements	4
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0406
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176759 (current)	2016-02-19	cif/2/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/00.	2002787.cif
26848	2011-09-28	cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree.	2002787.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.	2002787.cif
853	2009-11-16	cif/ Reconstructing spacegroup designators from the symmetry operators were possible. The comands used can be found in the log file reformat-spacegroups-2009.11.14.log committed with the current revision. Only lines that contained spacegroup designators were changed, and all files pass vcif test after the conversion.	2002787.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/'	2002787.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	2002787.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.	2002787.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)	2002787.cif