Crystallography Open Database

Information card for entry 1514646

Preview

Coordinates	1514646.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H13 F2 N4 O3 Pt
Calculated formula	C19 H13 F2 N4 O3 Pt
Title of publication	Light-emitting platinum(ii) complexes supported by tetradentate dianionic bis(N-heterocyclic carbene) ligands: towards robust blue electrophosphors
Authors of publication	Li, Kai; Cheng, Gang; Ma, Chensheng; Guan, Xiangguo; Kwok, Wai-Ming; Chen, Yong; Lu, Wei; Che, Chi-Ming
Journal of publication	Chemical Science
Year of publication	2013
Journal volume	4
Journal issue	6
Pages of publication	2630
a	6.9645 ± 0.0004 Å
b	25.7559 ± 0.0015 Å
c	9.9824 ± 0.0006 Å
α	90°
β	99.152 ± 0.001°
γ	90°
Cell volume	1767.82 ± 0.18 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.057
Residual factor for significantly intense reflections	0.0568
Weighted residual factors for significantly intense reflections	0.1501
Weighted residual factors for all reflections included in the refinement	0.1503
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1514646.cif
110209	2014-04-18	cif/ Adding structures of 1514646, 1514647 via cif-deposit CGI script.	1514646.cif