Crystallography Open Database

Information card for entry 4310887

Preview

Coordinates	4310887.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	none
Chemical name	PtCr(tc)4.0.5Et2O
Formula	C26 H45 Cr N4 O0.5 Pt S4
Calculated formula	C26 H40 Cr N4 O0.5 Pt S4
Title of publication	Crystallographic Evidence for Chromium-Platinum Interaction
Authors of publication	Thomas A. Scott; Besma Abbaoui; Hong-Cai Zhou
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	2459 - 2461
a	15.4221 ± 0.0003 Å
b	15.4221 ± 0.0003 Å
c	14.411 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	3427.53 ± 0.17 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	213 ± 2 K
Number of distinct elements	7
Space group number	130
Hermann-Mauguin space group symbol	P 4/n c c :2
Hall space group symbol	-P 4a 2ac
Residual factor for all reflections	0.0307
Residual factor for significantly intense reflections	0.0236
Weighted residual factors for significantly intense reflections	0.067
Weighted residual factors for all reflections included in the refinement	0.0745
Goodness-of-fit parameter for all reflections included in the refinement	1.122
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4310887.cif
129439	2015-01-07	cod/ (robertas@burundukas) Correcting values of _exptl_crystal_density_meas and _exptl_crystal_density_method data items: codsql "select codid from validation where message like '%\\'_exptl_crystal_density_meas\\' value \"not measured\" is %'" -NB \ \| codid2file \ \| xargs perl -i -pe "s/_exptl_crystal_density_meas\\s+'not +measured'/_exptl_crystal_density_meas ?/i; \ s/_exptl_crystal_density_method\\s+('not +measured'\|\\?\|none)/_exptl_crystal_density_method ./i"	4310887.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4310887.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4310887.cif
31986	2012-01-04	cif/ Changing more tags to match the dictionary specifications: -_diffrn_standards_interval_count none -_diffrn_standards_interval_time none -_diffrn_standards_number none +_diffrn_standards_interval_count 0 +_diffrn_standards_interval_time . +_diffrn_standards_number 0	4310887.cif
31985	2012-01-04	cif/ Canging data item '_diffrn_standards_decay_% none' to '_diffrn_standards_decay_% 0'.	4310887.cif
11788	2011-02-22	cif/4/ Redepositing CIFs that were formally processed with an old version of cif_fix_values script.	4310887.cif
5312	2011-01-03	cif/ Adding files, updated with the 'cif_fix_enum' program and the cif_core.dic dictionary. The enumerator values were fixed, mostly incorrect case, but also some values that had extra underscores, dashes or spaces. Unfortunately, 22 had non-ASCII characters with the 8-th bit set, and these got incorrectly interpreted as latin1 characters and converted to their UTF8 equivalents by Perl. To fix the structures, however, they need to be redeposited from the original files with the new CIFParser/cif_filter version.	4310887.cif
2379	2010-11-10	../uploads/cif-deposit/cod/cif Adding structures of 4310887 via cif-deposit CGI script.	4310887.cif