Crystallography Open Database

Information card for entry 4343431

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Coordinates	4343431.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H24 N O8 Zn2
Calculated formula	C39 H24 N O8 Zn2
Title of publication	Gas Sorption, Second-Order Nonlinear Optics, and Luminescence Properties of a Multifunctional srs-Type Metal-Organic Framework Built by Tris(4-carboxylphenylduryl)amine.
Authors of publication	He, Yan-Ping; Tan, Yan-Xi; Zhang, Jian
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	13
Pages of publication	6653 - 6656
a	34.736 ± 0.0006 Å
b	34.736 ± 0.0006 Å
c	34.736 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	41912.1 ± 1.3 Å³
Cell temperature	293.15 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	209
Hermann-Mauguin space group symbol	F 4 3 2
Hall space group symbol	F 4 2 3
Residual factor for all reflections	0.0723
Residual factor for significantly intense reflections	0.0692
Weighted residual factors for significantly intense reflections	0.224
Weighted residual factors for all reflections included in the refinement	0.229
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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