Crystallography Open Database

Information card for entry 7012974

Preview

Coordinates	7012974.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C86 H50 O33 P2 Pt3 Ru10
Calculated formula	C86 H50 O33 P2 Pt3 Ru10
Title of publication	The synthesis and characterisation of the cluster dianion [PtRu5C(CO)15]2? and its reactions with Au and Pt cationic fragments produced in situ
Authors of publication	Khimyak, Tetyana; Johnson, Brian F. G.; Hermans, Sophie; Bond, Andrew D.
Journal of publication	Dalton Transactions
Year of publication	2003
Journal issue	13
Pages of publication	2651
a	9.633 ± 0.0003 Å
b	14.7529 ± 0.0004 Å
c	16.9993 ± 0.0005 Å
α	76.962 ± 0.002°
β	77.017 ± 0.002°
γ	89.506 ± 0.002°
Cell volume	2291.15 ± 0.12 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0516
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0924
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
213973 (current)	2019-03-05	cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries.	7012974.cif
179833	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/29.	7012974.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7012974.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7012974.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7012974.cif