Crystallography Open Database

Information card for entry 4344037

Preview

Coordinates	4344037.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H33 Cl3 F6 N2 O4 Pt2
Calculated formula	C46 H33 Cl3 F6 N2 O4 Pt2
Title of publication	Photostable Fluorophenyl-Substituted Cyclometalated Platinum(II) Emitters for Monitoring of Molecular Oxygen in Real Time.
Authors of publication	Xing, Yang; Liu, Chun; Xiu, Jing-Hai; Li, Jiu-Yan
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	16
Pages of publication	7783 - 7790
a	13.2671 ± 0.001 Å
b	12.1276 ± 0.001 Å
c	26.656 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	4288.9 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0448
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.1628
Weighted residual factors for all reflections included in the refinement	0.169
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	4344037.cif
160500	2015-10-06	cif/ Updating files of 4344036, 4344037 Original log message: Adding full bibliography for 4344036--4344037.cif.	4344037.cif
152666	2015-08-01	cif/ Adding structures of 4344037 via cif-deposit CGI script.	4344037.cif