Crystallography Open Database

Information card for entry 4336625

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Coordinates	4336625.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H50 Ce N2 O18
Calculated formula	C78 H50 Ce N2 O18
Title of publication	Gas Sorption, Second-Order Nonlinear Optics, and Luminescence Properties of a Series of Lanthanide-Organic Frameworks Based on Nanosized Tris((4-carboxyl)phenylduryl)amine Ligand
Authors of publication	Yan-Ping He; Yan-Xi Tan; Jian Zhang
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12758 - 12762
a	35.7507 ± 0.0007 Å
b	16.3257 ± 0.0003 Å
c	13.1559 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	7678.5 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	41
Hermann-Mauguin space group symbol	A b a 2
Hall space group symbol	A 2 -2ab
Residual factor for all reflections	0.0597
Residual factor for significantly intense reflections	0.0577
Weighted residual factors for significantly intense reflections	0.1555
Weighted residual factors for all reflections included in the refinement	0.1579
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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