Crystallography Open Database

Information card for entry 7202587

7202586 << 7202587 >> 7202588

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Coordinates	7202587.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33.5 H18 Cl F10 Ir N4
Calculated formula	C33.5 H18 Cl F10 Ir N4
Title of publication	Novel host material for highly efficient blue phosphorescent OLEDs
Authors of publication	Shih, Ping-I; Chien, Chen-Han; Chuang, Chu-Ying; Shu, Ching-Fong; Yang, Cheng-Han; Chen, Jian-Hong; Chi, Yun
Journal of publication	Journal of Materials Chemistry
Year of publication	2007
Journal volume	17
Journal issue	17
Pages of publication	1692
a	10.0361 ± 0.0001 Å
b	11.1106 ± 0.0001 Å
c	14.0054 ± 0.0001 Å
α	96.0383 ± 0.0007°
β	90.759 ± 0.0006°
γ	107.019 ± 0.0005°
Cell volume	1483.43 ± 0.02 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 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	0.0314
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0653
Weighted residual factors for all reflections included in the refinement	0.0696
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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