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Information card for 7205974

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Coordinates

7205974.cif

Structure parameters

Formula - C72 H84 Cl3 N11 Ni4 O28 -
Calculated formula - C72 H84 Cl3 N11 Ni4 O28 -
Title of publication Co-crystallization of coordination compounds through second-coordination sphere interactions
Authors of publication Cucos, Andrei; Ursu, Andrei; Madalan, Augustin M.; Duhayon, Carine; Sutter, Jean-Pascal; Andruh, Marius
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 11
Pages of publication 3756
a 14.8436 ± 0.0013 Å
b 15.6993 ± 0.0012 Å
c 17.3575 ± 0.0013 Å
α 97.492 ± 0.006°
β 97.828 ± 0.007°
γ 91.792 ± 0.007°
Cell volume 3968 ± 0.6 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group P -1
Hall symmetry space group -P 1
Residual factor for all reflections 0.1251
Residual factor for observed reflections 0.0563
Weighted residual factors for the observed reflections 0.0828
Weighted residual factors for all reflections included in the refinement 0.0961
Goodness-of-fit parameter for observed reflections 0.899
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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