Crystallography Open Database

Information card for entry 7055259

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Coordinates	7055259.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H43 Cu N4 O2 P2
Calculated formula	C56 H43 Cu N4 O2 P2
Title of publication	Influences of the protonic state of an imidazole-phenanthroline ligand on the luminescence properties of copper(i) complexes: experimental and theoretical research
Authors of publication	Liu, Xinfang; Li, Rongfang; Ma, Lufang; Feng, Xun; Ding, Yuqiang
Journal of publication	New J. Chem.
Year of publication	2016
Journal volume	40
Journal issue	1
Pages of publication	619
a	13.0549 ± 0.0002 Å
b	13.6031 ± 0.0002 Å
c	14.2237 ± 0.0002 Å
α	73.079 ± 0.001°
β	75.249 ± 0.001°
γ	87.895 ± 0.001°
Cell volume	2335.03 ± 0.06 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	0.0459
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.0974
Weighted residual factors for all reflections included in the refinement	0.1039
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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