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Information card for entry 7001407
Preview
Coordinates | 7001407.cif |
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Original paper (by DOI) | HTML |
Formula | C21 H24 Br3 Cu3 N6 |
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Calculated formula | C21 H24 Br3 Cu3 N6 |
SMILES | [Cu]123[Br][Cu]45[Br][Cu]6([Br]1)[N]1(C[N]2(Cc2cccc[n]32)C[N]4(Cc3cccc[n]53)C1)Cc1cccc[n]61 |
Title of publication | Triangular tricopper(i) clusters supported by donor-substituted triazacyclohexanes |
Authors of publication | Köhn, Randolf D.; Tomás Laudo, Lorena; Pan, Zhida; Speiser, Fredy; Kociok-Köhn, Gabriele |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 23 |
Pages of publication | 4556 - 4568 |
a | 7.3337 ± 0.0003 Å |
b | 10.5558 ± 0.0005 Å |
c | 18.1198 ± 0.0008 Å |
α | 74.658 ± 0.002° |
β | 81.92 ± 0.002° |
γ | 86.404 ± 0.002° |
Cell volume | 1338.81 ± 0.1 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1059 |
Residual factor for significantly intense reflections | 0.0488 |
Weighted residual factors for significantly intense reflections | 0.0911 |
Weighted residual factors for all reflections included in the refinement | 0.1065 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.922 |
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/7001407.html
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