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Information card for entry 4109020
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Coordinates | 4109020.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Bis(2,3-dimethylpyridinium) tetrabromocuprate |
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Formula | C14 H20 Br4 Cu N2 |
Calculated formula | C14 H20 Br4 Cu N2 |
SMILES | [Cu](Br)(Br)([Br-])[Br-].[nH+]1c(c(ccc1)C)C.[nH+]1c(c(ccc1)C)C |
Title of publication | Synthesis, Structure, and Magnetic Properties of an Antiferromagnetic Spin-Ladder Complex: Bis(2,3-dimethylpyridinium) Tetrabromocuprate |
Authors of publication | Alexander Shapiro; Christopher P. Landee; Mark M. Turnbull; Joaquim Jornet; Mercè Deumal; Juan J. Novoa; Michael A. Robb; William Lewis |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2007 |
Journal volume | 129 |
Pages of publication | 952 - 959 |
a | 7.5037 ± 0.0006 Å |
b | 31.613 ± 0.003 Å |
c | 8.2016 ± 0.0007 Å |
α | 90° |
β | 98.972 ± 0.002° |
γ | 90° |
Cell volume | 1921.7 ± 0.3 Å3 |
Cell temperature | 88 ± 2 K |
Ambient diffraction temperature | 88 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0573 |
Residual factor for significantly intense reflections | 0.0359 |
Weighted residual factors for significantly intense reflections | 0.0672 |
Weighted residual factors for all reflections included in the refinement | 0.0724 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4109020.html
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