Crystallography Open Database

Information card for entry 1515476

Preview

Structure parameters

Formula	C34 H69 P5 Pt2
Calculated formula	C34 H69 P5 Pt2
SMILES	[Pt]12([Pt]3([P](CC[P]3(C(C)C)C(C)C)(C(C)C)C(C)C)P1c1ccccc1)[P](C(C)C)(CC[P]2(C(C)C)C(C)C)C(C)C
Title of publication	Terminal hafnium phosphinidene complexes and phosphinidene ligand exchange
Authors of publication	Waterman, Rory; Tilley, T. Don
Journal of publication	Chemical Science
Year of publication	2011
Journal volume	2
Journal issue	7
Pages of publication	1320
a	11.699 ± 0.003 Å
b	15.37 ± 0.004 Å
c	45.229 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	8133 ± 4 Å³
Cell temperature	139 ± 2 K
Ambient diffraction temperature	139 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1243
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.0799
Weighted residual factors for all reflections included in the refinement	0.0965
Goodness-of-fit parameter for all reflections included in the refinement	0.884
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
301776 (current)	2025-08-18	Add cross-references to PubChem compounds in COD range 1/51 Each referenced PubChem compound corresponds to the full crystal structure.	1515476.cif
176729	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1515476.cif
111825	2014-04-28	cif/ Adding structures of 1515475, 1515476 via cif-deposit CGI script.	1515476.cif