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Information card for entry 7019734
Preview
Coordinates | 7019734.cif |
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Original paper (by DOI) | HTML |
Formula | C13 H17 Cu N3 O7 |
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Calculated formula | C13 H17 Cu N3 O7 |
SMILES | C1(=O)C(C)=[N]2[Cu](O1)(OC(=N2)c1cc(c(cc1)N(=O)=O)C)([OH]C)[OH]C |
Title of publication | Synthesis, characterisation and antitubercular activities of a series of pyruvate-containing aroylhydrazones and their Cu-complexes. |
Authors of publication | Jamadar, Abeda; Duhme-Klair, Anne-K; Vemuri, Kiranmayi; Sritharan, Manjula; Dandawate, Prasad; Padhye, Subhash |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2012 |
Journal volume | 41 |
Journal issue | 30 |
Pages of publication | 9192 - 9201 |
a | 10.159 ± 0.003 Å |
b | 14.1559 ± 0.0007 Å |
c | 11.895 ± 0.002 Å |
α | 90° |
β | 114.11 ± 0.03° |
γ | 90° |
Cell volume | 1561.4 ± 0.6 Å3 |
Cell temperature | 110 K |
Ambient diffraction temperature | 110 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 | 0.0377 |
Residual factor for significantly intense reflections | 0.03 |
Weighted residual factors for significantly intense reflections | 0.0682 |
Weighted residual factors for all reflections included in the refinement | 0.0723 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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