Crystallography Open Database

Information card for entry 7233607

Preview

Coordinates	7233607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H23 F6 Ir N4 O2
Calculated formula	C38 H23 F6 Ir N4 O2
Title of publication	Syntheses, photoluminescence and electroluminescence of four heteroleptic iridium complexes with 2-(5-phenyl-1,3,4-oxadiazol-2-yl)-phenol derivatives as ancillary ligands
Authors of publication	Hong-Yan Li; Tian-Yi Li; Ming-Yu Teng; Qiu-Lei Xu; Song Zhang; Yi-Ming Jin; Xuan Liu; You-Xuan Zheng; Jing-Lin Zuo
Journal of publication	Journal of Materials Chemistry C
Year of publication	2014
Journal volume	2
Pages of publication	1116 - 1124
a	12.9055 ± 0.0005 Å
b	15.0122 ± 0.0005 Å
c	20.3242 ± 0.0007 Å
α	92.209 ± 0.001°
β	108.391 ± 0.001°
γ	110.069 ± 0.001°
Cell volume	3461.7 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0686
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1128
Weighted residual factors for all reflections included in the refinement	0.1179
Goodness-of-fit parameter for all reflections included in the refinement	0.889
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
217915 (current)	2019-09-02	cif/ Adding structures of 7233607 via cif-deposit CGI script.	7233607.cif