Crystallography Open Database

Information card for entry 1561382

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Coordinates	1561382.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H60 Mg3 N6 O42 P6
Calculated formula	C84 H60 Mg3 N6 O42 P6
Title of publication	Alkaline earth-based coordination polymers derived from a cyclotriphosphazene-functionalized hexacarboxylate
Authors of publication	Ling, Yajing; Bai, Dongjie; Feng, Yunlong; He, Yabing
Journal of publication	Journal of Solid State Chemistry
Year of publication	2016
Journal volume	242
Pages of publication	47 - 54
a	18.571 ± 0.0013 Å
b	18.571 ± 0.0013 Å
c	28.8779 ± 0.0015 Å
α	90°
β	90°
γ	120°
Cell volume	8625.2 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.1483
Residual factor for significantly intense reflections	0.1047
Weighted residual factors for significantly intense reflections	0.2642
Weighted residual factors for all reflections included in the refinement	0.2971
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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