Crystallography Open Database





Information card for 4115226

4115225 << 4115226 >> 4115227

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Coordinates

4115226.cif

Structure parameters

Formula - C62 H64 Cl2 Mn2 N10 Ni O14 -
Calculated formula - C62 H62 Cl2 Mn2 N10 Ni O14 -
Title of publication Evidence for Single-Chain Magnet Behavior in a MnIII-NiII Chain Designed with High Spin Magnetic Units: A Route to High Temperature Metastable Magnets
Authors of publication Rodolphe Clérac; Hitoshi Miyasaka; Masahiro Yamashita; Claude Coulon
Journal of publication Journal of the American Chemical Society
Year of publication 2002
Journal volume 124
Pages of publication 12837 - 12844
a 21.14 ± 0.003 Å
b 15.975 ± 0.001 Å
c 18.6212 ± 0.0004 Å
α 90°
β 98.0586 ± 0.0004°
γ 90°
Cell volume 6226.5 ± 1 Å3
Cell temperature 293.2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Residual factor for observed reflections 0.0573
Weighted residual factors for all reflections included in the refinement 0.157
Goodness-of-fit parameter for observed reflections 1.734
Diffraction radiation wavelength 0.7107 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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