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Information card for 1100982

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Coordinates

1100982.cif

Structure parameters

Formula - C52 H58 Co F6 N2 O2 Pd -
Calculated formula - C52 H58 Co F6 N2 O2 Pd -
Title of publication Structural Characterization of Four Members of the Electron-Transfer Series [PdII(L)2)2]n (L = o-Iminophenolate Derivative; n= 2-, 1-, 0, 1+, 2+). Ligand Mixed Valency in the Monocation and Monoanion with S=1/2 Ground States
Authors of publication Swarnalatha Kokatam; Thomas Weyhermüller; Eberhard Bothe; Phalguni Chaudhuri; Karl Wieghardt
Journal of publication Inorganic Chemistry
Year of publication 2005
Journal volume 44
Pages of publication 3709 - 3717
a 10.1173 ± 0.0006 Å
b 10.4874 ± 0.0006 Å
c 12.6206 ± 0.0006 Å
α 67.012 ± 0.005°
β 73.738 ± 0.005°
γ 88.769 ± 0.005°
Cell volume 1177.57 ± 0.13 Å3
Cell temperature 100 ± 2 K
Ambient diffraction temperature 100 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P 1
Hall symmetry space group P 1
Residual factor for all reflections 0.0308
Residual factor for observed reflections 0.03
Weighted residual factors for the observed reflections 0.0736
Weighted residual factors for all reflections included in the refinement 0.0742
Goodness-of-fit parameter for observed reflections 1.024
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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