Crystallography Open Database

Information card for entry 4515347

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Coordinates	4515347.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H20 N2 O4 Zn
Calculated formula	C31 H20 N2 O4 Zn
Title of publication	Targeted Construction of Light-Harvesting Metal-Organic Frameworks Featuring Efficient Host-Guest Energy Transfer.
Authors of publication	Zhao, Xiaoyu; Song, Xiaoyu; Li, Yang; Chang, Ze; Chen, Long
Journal of publication	ACS applied materials & interfaces
Year of publication	2018
Journal volume	10
Journal issue	6
Pages of publication	5633 - 5640
a	16.8016 ± 0.0018 Å
b	16.8016 ± 0.0018 Å
c	25.828 ± 0.005 Å
α	90°
β	90°
γ	120°
Cell volume	6314.3 ± 1.6 Å³
Cell temperature	113 K
Ambient diffraction temperature	113 K
Number of distinct elements	5
Space group number	181
Hermann-Mauguin space group symbol	P 64 2 2
Hall space group symbol	P 64 2 (0 0 2)
Residual factor for all reflections	0.1181
Residual factor for significantly intense reflections	0.0824
Weighted residual factors for significantly intense reflections	0.2253
Weighted residual factors for all reflections included in the refinement	0.2472
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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