Crystallography Open Database

Information card for entry 7719192

7719191 << 7719192 >> 7719193

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Coordinates	7719192.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	1
Formula	C H F Ir N O
Calculated formula	C4.64 H3.92 F0.16 Ir0.08 N0.56 O0.32
Title of publication	Strategic Fluorine Atom Positioning in Carbazolyl Oxadiazole Derivatives: Constructing Asymmetric Ir(III) Complexes for Enhanced Electroluminescent Performance
Authors of publication	Liu, Jia-Wei; Wang, Xuecheng; Wen, Li-Jing; Chen, Hao-yu; Ren, Jin-Xia; Li, Jie; Liu, Chang; Li, Yong-Hua; Chen, Bo; Wang, Shi; Zhang, Kenneth Yin
Journal of publication	Dalton Transactions
Year of publication	2025
a	12.285 ± 0.002 Å
b	13.996 ± 0.002 Å
c	16.348 ± 0.003 Å
α	83.091 ± 0.004°
β	76.754 ± 0.004°
γ	66.757 ± 0.003°
Cell volume	2512.6 ± 0.7 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 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	0.1493
Residual factor for significantly intense reflections	0.0947
Weighted residual factors for significantly intense reflections	0.1907
Weighted residual factors for all reflections included in the refinement	0.2203
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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
301423 (current)	2025-08-01	cif/ Adding structures of 7719190, 7719191, 7719192 via cif-deposit CGI script.	7719192.cif