Crystallography Open Database

Information card for entry 4349873

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Coordinates	4349873.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H43 Ho2 N4 O19 P3
Calculated formula	C51 H43 Ho2 N4 O19 P3
Title of publication	Structural diversities and gas adsorption properties of a family of rod-packing lanthanide‒organic frameworks based on cyclotriphosphazene-functionalized hexacarboxylate derivatives
Authors of publication	Bai, Dongjie; Wang, Yao; He, Minghui; Gao, Xiaoxia; He, Yabing
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2018
Journal volume	5
Journal issue	9
Pages of publication	2227
a	54.516 ± 0.006 Å
b	7.8411 ± 0.0008 Å
c	27.411 ± 0.003 Å
α	90°
β	114.783 ± 0.005°
γ	90°
Cell volume	10638 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0297
Residual factor for significantly intense reflections	0.0251
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.0943
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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