Crystallography Open Database

Information card for entry 4340392

Preview

Coordinates	4340392.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H48 F15 N3 Pt
Calculated formula	C47 H48 F15 N3 Pt
SMILES	[Pt]([N](=CNc1ccccc1)c1ccccc1)(c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.[N+](CCCC)(CCCC)(CCCC)CCCC
Title of publication	Synthesis and in solution and solid state structural study of intramolecular Pt...H interactions in pentafluorophenyl platinum(II) complexes containing the ligands triazene, formamidine, and 2-aminopyridine.
Authors of publication	Casas, José M; Diosdado, Beatriz E.; Falvello, Larry R.; Forniés, Juan; Martín, Antonio
Journal of publication	Inorganic chemistry
Year of publication	2005
Journal volume	44
Journal issue	25
Pages of publication	9444 - 9452
a	10.2221 ± 0.0007 Å
b	18.3393 ± 0.0013 Å
c	25.027 ± 0.003 Å
α	90°
β	101.522 ± 0.009°
γ	90°
Cell volume	4597.2 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
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	0.1044
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1494
Weighted residual factors for all reflections included in the refinement	0.1912
Goodness-of-fit parameter for all reflections included in the refinement	0.87
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
179506 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/03.	4340392.cif
119820	2014-07-09	cif/ Adding structures of 4340391, 4340392, 4340393, 4340394 via cif-deposit CGI script.	4340392.cif