Crystallography Open Database

Information card for entry 4307262

Preview

Coordinates	4307262.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H48 Cu2 Mn N14 O14
Calculated formula	C52 H44 Cu2 Mn N14 O14.01
Title of publication	Heteronuclear Complexes of Macrocyclic Oxamide with Co-ligands: Syntheses, Crystal Structures, and Magnetic Properties
Authors of publication	Li-Na Zhu; Na Xu; Wei Zhang; Dai-Zheng Liao; Kazuyoshi Yoshimura; Ko Mibu; Zong-Hui Jiang; Shi-Ping Yan; Peng Cheng
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	1297 - 1304
a	39.131 ± 0.009 Å
b	13.082 ± 0.003 Å
c	28.121 ± 0.007 Å
α	90°
β	114.53 ± 0.004°
γ	90°
Cell volume	13096 ± 5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1571
Residual factor for significantly intense reflections	0.0792
Weighted residual factors for significantly intense reflections	0.2258
Weighted residual factors for all reflections included in the refinement	0.2819
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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