Crystallography Open Database





Information card for 7015677

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Coordinates

7015677.cif

Structure parameters

Formula - C28 H24 Br4 Fe Hg2 N P -
Calculated formula - C28 H24 Br4 Fe Hg2 N P -
Title of publication The coordination behaviour of ferrocene-based pyridylphosphine ligands towards Zn(II), Cd(II) and Hg(II).
Authors of publication Siemeling, Ulrich; Klemann, Thorsten; Bruhn, Clemens; Schulz, Jiří; Štěpnička, Petr
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 17
Pages of publication 4722 - 4740
a 34.972 ± 0.0012 Å
b 9.941 ± 0.0005 Å
c 18.1638 ± 0.0008 Å
α 90°
β 90°
γ 90°
Cell volume 6314.8 ± 0.5 Å3
Cell temperature 173 ± 2 K
Ambient diffraction temperature 173 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P c c n
Hall symmetry space group -P 2ab 2ac
Residual factor for all reflections 0.0681
Residual factor for observed reflections 0.0548
Weighted residual factors for the observed reflections 0.136
Weighted residual factors for all reflections included in the refinement 0.1469
Goodness-of-fit parameter for observed reflections 1.067
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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