Crystallography Open Database





Information card for 7205834

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Coordinates

7205834.cif

Structure parameters

Formula - C50 H60 Cl0 Mn4 N0 O20 -
Calculated formula - C50 H56 Mn4 O20 -
Title of publication Two new ferrimagnetic MnII-carboxylate coordination polymers constructed from 5-tert-butyl isophthalic acid with (5/2, 15/2) and (5/2, 10/2) spin topologies
Authors of publication Tian, Chong-Bin; He, Zhang-Zhen; Li, Zhi-Hua; Lin, Ping; Du, Shao-Wu
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 8
Pages of publication 3080
a 11.6608 ± 0.0006 Å
b 39.3981 ± 0.0019 Å
c 24.4617 ± 0.0012 Å
α 90°
β 101.297 ± 0.003°
γ 90°
Cell volume 11020.3 ± 1 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Residual factor for all reflections 0.0628
Residual factor for observed reflections 0.0574
Weighted residual factors for the observed reflections 0.1828
Weighted residual factors for all reflections included in the refinement 0.1885
Goodness-of-fit parameter for observed reflections 0.991
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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