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Information card for entry 1549870
Preview
Coordinates | 1549870.cif |
---|---|
Structure factors | 1549870.hkl |
Original IUCr paper | HTML |
Chemical name | 3,3'-Dimethyl-1,1'-methylenediimidazolium tetrabromidocobaltate(II) |
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Formula | C9 H14 Br4 Co N4 |
Calculated formula | C9 H14 Br4 Co N4 |
SMILES | c1n(cc[n+]1C)Cn1c[n+](cc1)C.[Co](Br)(Br)([Br-])[Br-] |
Title of publication | 3,3'-Dimethyl-1,1'-methylenediimidazolium tetrabromidocobaltate(II) |
Authors of publication | Peppel, Tim; Spannenberg, Anke |
Journal of publication | IUCrData |
Year of publication | 2018 |
Journal volume | 3 |
Journal issue | 8 |
Pages of publication | x181212 |
a | 15.7782 ± 0.0015 Å |
b | 7.4076 ± 0.0007 Å |
c | 28.567 ± 0.003 Å |
α | 90° |
β | 95.7271 ± 0.0019° |
γ | 90° |
Cell volume | 3322.2 ± 0.6 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.033 |
Residual factor for significantly intense reflections | 0.0239 |
Weighted residual factors for significantly intense reflections | 0.0457 |
Weighted residual factors for all reflections included in the refinement | 0.0481 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
210293 (current) | 2018-09-01 | cif/ hkl/ Adding structures of 1549870 via cif-deposit CGI script. |
1549870.cif 1549870.hkl |
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Users of the data should acknowledge the original authors of the
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