Crystallography Open Database

Information card for entry 4072919

Preview

Coordinates	4072919.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H18 F12 O2 Pt S2
Calculated formula	C20 H18 F12 O2 Pt S2
SMILES	[Pt]([S](=O)(C)C)([S](=O)(C)C)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Title of publication	Monoarylplatinum(II) Complexes with a 2-Phenylpyridyl Ligand and Coordinated Solvent, [Pt(Ar)(Phpy)(solv)] (Phpy = 2-phenylpyridyl; solv = NCCH3, dmso). Preparation from [Pt(Ar)2(solv)2], Structures, and Chemical Properties
Authors of publication	Yagyu, Takeyoshi; Ohashi, Jun-ichi; Maeda, Masunobu
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	9
Pages of publication	2383
a	8.5086 ± 0.0002 Å
b	15.891 ± 0.0007 Å
c	19.133 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2586.98 ± 0.19 Å³
Cell temperature	173.2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for significantly intense reflections	0.0248
Weighted residual factors for all reflections included in the refinement	0.0552
Goodness-of-fit parameter for all reflections included in the refinement	0.593
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4072919.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4072919.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4072919.cif
46074	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4072918, 4072919, 4072920, 4072921, 4072922, 4072923 via cif-deposit CGI script.	4072919.cif