Crystallography Open Database

Information card for entry 7234580

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Coordinates	7234580.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C149 H137 Ag6 Cl7 Cu O4 P9 S6
Calculated formula	C146 H131 Ag6 Cl0.5 Cu O2 P9 S6
Title of publication	High-efficiency solution-processed OLEDs based on cationic Ag6Cu heteroheptanuclear cluster complexes with aromatic acetylides
Authors of publication	Liang-Jin Xu; Xu Zhang; Jin-Yun Wang; Zhong-Ning Chen
Journal of publication	Journal of Materials Chemistry C
Year of publication	2016
Journal volume	4
Pages of publication	1787 - 1794
a	30.958 ± 0.0002 Å
b	30.958 ± 0.0002 Å
c	30.958 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	29670.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0624
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1848
Weighted residual factors for all reflections included in the refinement	0.1862
Goodness-of-fit parameter for all reflections included in the refinement	1.127
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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