Crystallography Open Database





Information card for 4114686

4114685 << 4114686 >> 4114687

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Coordinates

4114686.cif

Structure parameters

Chemical name (K-2,2,2-crypt)2[Ge9(BiPh2)2].en
Formula - C62 H100 Bi2 Ge9 K2 N6 O12 -
Calculated formula - C62 H100 Bi2 Ge9 K2 N6 O12 -
Title of publication [Ph2Bi-(Ge9)-BiPh2]2-: A Deltahedral Zintl Ion Functionalized by Exo-Bonded Ligands
Authors of publication Angel Ugrinov; Slavi C. Sevov
Journal of publication Journal of the American Chemical Society
Year of publication 2002
Journal volume 124
Pages of publication 2442 - 2443
a 13.5216 ± 0.0009 Å
b 13.6028 ± 0.0009 Å
c 24.4984 ± 0.0017 Å
α 79.7 ± 0.001°
β 77.003 ± 0.001°
γ 65.881 ± 0.001°
Cell volume 3988.1 ± 0.5 Å3
Cell temperature 193 ± 2 K
Ambient diffraction temperature 193 ± 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 0.0564
Residual factor for observed reflections 0.0457
Weighted residual factors for the observed reflections 0.1133
Weighted residual factors for all reflections included in the refinement 0.1175
Goodness-of-fit parameter for observed reflections 1.026
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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