Crystallography Open Database

Information card for entry 4061742

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Coordinates	4061742.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H49 F3 O3 Os P2 S
Calculated formula	C28 H49 F3 O3 Os P2 S
SMILES	[OsH]12345([P](C(C1)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)[cH]1[cH]2[cH]3[c]24[c]51cccc2.S(=O)(=O)([O-])C(F)(F)F
Title of publication	A Useful Access to the Chemistry of the Indenyl-Osmium-Triisopropyl Moiety
Authors of publication	Esteruelas, M. A.; López, A. M. L.; Oñate, E.; Royo, E.
Journal of publication	Organometallics
Year of publication	2005
a	13.538 ± 0.003 Å
b	16.233 ± 0.004 Å
c	14.163 ± 0.003 Å
α	90°
β	91.48 ± 0.004°
γ	90°
Cell volume	3111.3 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178514 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/17.	4061742.cif
120677	2014-07-23	cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot.	4061742.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4061742.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.	4061742.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.	4061742.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/'	4061742.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	4061742.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.	4061742.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)	4061742.cif