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Information card for entry 7015534
Preview
Coordinates | 7015534.cif |
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Original paper (by DOI) | HTML |
Formula | C7 H7 Cl2 Cu N7 |
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Calculated formula | C7 H7 Cl2 Cu N7 |
SMILES | [Cu]12(Cl)(Cl)[N](Cc3cccc(C[N]2=N#N)[n]13)=N#N |
Title of publication | Tridentate complexes of 2,6-bis(4-substituted-1,2,3-triazol-1-ylmethyl)pyridine and its organic azide precursors: an application of the copper(II) acetate-accelerated azide-alkyne cycloaddition. |
Authors of publication | Brotherton, Wendy S.; Guha, Pampa M.; Phan, Hoa; Clark, Ronald J.; Shatruk, Michael; Zhu, Lei |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 14 |
Pages of publication | 3655 - 3665 |
a | 15.1972 ± 0.0007 Å |
b | 12.5443 ± 0.0006 Å |
c | 14.1168 ± 0.001 Å |
α | 90° |
β | 119.04° |
γ | 90° |
Cell volume | 2352.9 ± 0.2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0235 |
Residual factor for significantly intense reflections | 0.0209 |
Weighted residual factors for significantly intense reflections | 0.0537 |
Weighted residual factors for all reflections included in the refinement | 0.0553 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.974 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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