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Information card for entry 4112641
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Coordinates | 4112641.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [Cr3(depa)4Cl2]I3 |
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Formula | C56 H64 Cl2 Cr3 I3 N12 |
Calculated formula | C56 H64 Cl2 Cr3 I3 N12 |
Title of publication | Molecular and Electronic Structures by Design: Tuning Symmetrical and Unsymmetrical Linear Trichromium Chains |
Authors of publication | John F. Berry; F. Albert Cotton; Tongbu Lu; Carlos A. Murillo; Brian K. Roberts; Xiaoping Wang |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2004 |
Journal volume | 126 |
Pages of publication | 7082 - 7096 |
a | 17.9292 ± 0.0012 Å |
b | 17.9292 ± 0.0012 Å |
c | 21.828 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7016.7 ± 1.2 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 6 |
Space group number | 120 |
Hermann-Mauguin space group symbol | I -4 c 2 |
Hall space group symbol | I -4 -2c |
Residual factor for all reflections | 0.1044 |
Residual factor for significantly intense reflections | 0.0984 |
Weighted residual factors for significantly intense reflections | 0.2526 |
Weighted residual factors for all reflections included in the refinement | 0.2588 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4112641.html
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