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Information card for entry 7040172
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Coordinates | 7040172.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H11 Cl N6 |
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Calculated formula | C12 H11 Cl N6 |
Title of publication | Mechanochemical and thermal formation of 1H-benzotriazole coordination polymers and complexes of 3d-transition metals with intriguing dielectric properties. |
Authors of publication | Brede, Franziska A.; Mühlbach, Friedrich; Sextl, Gerhard; Müller-Buschbaum, Klaus |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 26 |
Pages of publication | 10609 - 10619 |
a | 25.984 ± 0.005 Å |
b | 3.8567 ± 0.0008 Å |
c | 14.587 ± 0.003 Å |
α | 90° |
β | 119.39 ± 0.03° |
γ | 90° |
Cell volume | 1273.7 ± 0.6 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
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 | 0.0407 |
Residual factor for significantly intense reflections | 0.0329 |
Weighted residual factors for significantly intense reflections | 0.0775 |
Weighted residual factors for all reflections included in the refinement | 0.0822 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
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/7040172.html
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