Crystallography Open Database

Information card for entry 4331934

4331933 << 4331934 >> 4331935

Preview

Coordinates	4331934.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H34 Cl2 N6 O4 Pt
Calculated formula	C16 H34 Cl2 N6 O4 Pt
SMILES	C(CC)(=[NH][Pt]([NH]=C(CC)ONC(C)(C)C(=N\O)\C)(Cl)Cl)ONC(C)(C)/C(=N/O)C
Title of publication	Kinetic and Thermodynamic Aspects of the Regioselective Addition of Bifunctional Hydroxylaminooxime-type HO-Nucleophiles to Pt-Complexed Nitriles
Authors of publication	Luzyanin, Konstantin V.; Kukushkin, Vadim Yu.; Kuznetsov, Maxim L.; Ryabov, Alexander D.; Galanski, Markus; Haukka, Matti; Tretyakov, Eugene V.; Ovcharenko, Victor I.; Kopylovich, Maximilian N.; Pombeiro, Armando J. L.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	5
Pages of publication	2296 - 2306
a	7.6006 ± 0.0002 Å
b	15.4326 ± 0.0006 Å
c	10.153 ± 0.0003 Å
α	90°
β	99.141 ± 0.002°
γ	90°
Cell volume	1175.79 ± 0.07 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0337
Residual factor for significantly intense reflections	0.0272
Weighted residual factors for significantly intense reflections	0.0685
Weighted residual factors for all reflections included in the refinement	0.0722
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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
179422 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/19.	4331934.cif
97988	2014-01-29	cif/ Adding structures of 4331934, 4331935, 4331936, 4331937, 4331938 via cif-deposit CGI script.	4331934.cif