Crystallography Open Database

Information card for entry 4316175

Preview

Coordinates	4316175.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H5 Bi O8 Os2
Calculated formula	C14 H5 Bi O8 Os2
SMILES	[Os]1([Os]([Bi]1c1ccccc1)(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O]
Title of publication	Osmium-Bismuth Complexes from the Reaction of Os3(CO)11(NCMe) with BiPh3
Authors of publication	Richard D. Adams; William C. Pearl
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	7170 - 7175
a	9.5596 ± 0.0008 Å
b	10.0335 ± 0.0008 Å
c	10.7117 ± 0.0009 Å
α	94.491 ± 0.002°
β	106.687 ± 0.002°
γ	104.987 ± 0.002°
Cell volume	937.67 ± 0.14 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0523
Residual factor for significantly intense reflections	0.0328
Weighted residual factors for significantly intense reflections	0.0663
Weighted residual factors for all reflections included in the refinement	0.0735
Goodness-of-fit parameter for all reflections included in the refinement	0.97
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
179241 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/61.	4316175.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4316175.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4316175.cif
17004	2011-03-31	cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif \| sort \| xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} \| > cif_filter --add-cif-header {} \| > sponge {} ) 2>&1 \| grep NOTE; then svn revert {}; > fi' ) &	4316175.cif
9366	2011-02-09	../uploads/cif-deposit/cod/cif Adding structures of 4316175 via cif-deposit CGI script.	4316175.cif