Crystallography Open Database

Information card for entry 4109149

Preview

Coordinates	4109149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H56 O10 Os3 P2 Pt2
Calculated formula	C34 H56 O10 Os3 P2 Pt2
SMILES	[Pt]12([Os]34([Pt]56([Os]73([Os]145(C#[O])(C#[O])(C2=O)[H]7)(C#[O])(C#[O])(C#[O])[H]6)([P](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C#[O])(C#[O])(C#[O])C#[O])[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
Title of publication	Facile Activation of Hydrogen by an Unsaturated Platinum-Osmium Cluster Complex
Authors of publication	Richard D. Adams; Burjor Captain; Lei Zhu
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	2454 - 2455
a	27.9635 ± 0.001 Å
b	20.7892 ± 0.0007 Å
c	15.4264 ± 0.0006 Å
α	90°
β	105.65 ± 0.001°
γ	90°
Cell volume	8635.5 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0589
Residual factor for significantly intense reflections	0.0394
Weighted residual factors for significantly intense reflections	0.0854
Weighted residual factors for all reflections included in the refinement	0.0943
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
178837 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/91.	4109149.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4109149.cif
57903	2012-05-23	cif/ Adding structures of 4109149 via cif-deposit CGI script.	4109149.cif