Crystallography Open Database

Information card for entry 7237328

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Coordinates	7237328.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H28 B F20 Ir N4
Calculated formula	C64 H28 B F20 Ir N4
Title of publication	High-performance yellow- and orange-emitting diodes based on novel sublimable cationic iridium(iii) complexes by ligand control
Authors of publication	Ma, Dongxin; Liu, Ruihuan; Qiu, Yong; Duan, Lian
Journal of publication	Journal of Materials Chemistry C
Year of publication	2018
Journal volume	6
Journal issue	21
Pages of publication	5630
a	17.421 ± 0.004 Å
b	17.68 ± 0.004 Å
c	18.115 ± 0.004 Å
α	93.23 ± 0.03°
β	92.79 ± 0.03°
γ	101.64 ± 0.03°
Cell volume	5446 ± 2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153.15 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	0.0557
Residual factor for significantly intense reflections	0.0451
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1837
Goodness-of-fit parameter for all reflections included in the refinement	1.163
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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