Crystallography Open Database

Information card for entry 8107711

Preview

Coordinates	8107711.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H14 Cl2 F4 N2 Pt
Calculated formula	C22 H14 Cl2 F4 N2 Pt
SMILES	[Pt](Cl)(Cl)([n]1ccccc1c1c(F)cc(F)cc1)[n]1c(c2ccc(F)cc2F)cccc1
Title of publication	Crystal structure of dichlorido-bis[2-(2,4-difluorophenyl)pyridine-κ 1N]platinum(II), C22H14Cl2F4N2Pt
Authors of publication	Cheng, Chen-En-Ze; Zhang, Jian-Guo; Tan, Wei; Zou, Hao
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	6
Pages of publication	1233 - 1235
a	16.858 ± 0.009 Å
b	14.876 ± 0.008 Å
c	17.125 ± 0.009 Å
α	90°
β	98.552 ± 0.006°
γ	90°
Cell volume	4247 ± 4 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 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	0.0527
Residual factor for significantly intense reflections	0.0337
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0778
Goodness-of-fit parameter for all reflections included in the refinement	0.996
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
287975 (current)	2023-12-04	cif/ Adding structures of 8107711 via cif-deposit CGI script.	8107711.cif