Crystallography Open Database

Information card for entry 4328651

Preview

Coordinates	4328651.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H72 K2 N2 O12 P4
Calculated formula	C24 H72 K2 N2 O12 P4
Title of publication	Tetravalent Titanium, Zirconium, and Cerium Oxo and Peroxo Complexes Containing an Imidodiphosphinate Ligand
Authors of publication	Guo-Cang Wang; Herman H. Y. Sung; Ian D. Williams; Wa-Hung Leung
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	3640 - 3647
a	8.6985 ± 0.0005 Å
b	9.8922 ± 0.0007 Å
c	13.7471 ± 0.0009 Å
α	75.538 ± 0.006°
β	78.294 ± 0.005°
γ	69.645 ± 0.006°
Cell volume	1065.09 ± 0.13 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 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	0.0552
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.1393
Weighted residual factors for all reflections included in the refinement	0.1419
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179389 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/86.	4328651.cif
77645	2013-03-29	cif/ Adding structures of 4328651 via cif-deposit CGI script.	4328651.cif