Crystallography Open Database

Information card for entry 4305499

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Coordinates	4305499.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H28 Mn3 N12 O10
Calculated formula	C44 H24 Mn3 N12 O10
Title of publication	Supramolecular Engineering of a 2D Kagomé Lattice: Synthesis, Structures, and Magnetic Properties
Authors of publication	Yan-Feng Yue; Jue Liang; En-Qing Gao; Chen-Jie Fang; Zheng-Guang Yan; Chun-Hua Yan
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	6115 - 6117
a	9.8878 ± 0.0002 Å
b	20.1939 ± 0.0003 Å
c	21.1225 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	4217.6 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0804
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.0778
Weighted residual factors for all reflections included in the refinement	0.0861
Goodness-of-fit parameter for all reflections included in the refinement	0.92
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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