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Information card for entry 7058943
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Coordinates | 7058943.cif |
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Original paper (by DOI) | HTML |
Common name | di(1-amino-5-methyltetrazolyl) dipicrato copper(II) semihydrate |
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Chemical name | di(1-amino-5-methyltetrazolyl) dipicrato copper(II) semihydrate |
Formula | C32 H30 Cu2 N32 O29 |
Calculated formula | C32 H30 Cu2 N32 O29 |
Title of publication | Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions |
Authors of publication | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin |
Journal of publication | New Journal of Chemistry |
Year of publication | 2019 |
a | 16.5743 ± 0.0008 Å |
b | 15.0908 ± 0.0007 Å |
c | 22.2088 ± 0.001 Å |
α | 90° |
β | 103.28 ± 0.004° |
γ | 90° |
Cell volume | 5406.3 ± 0.4 Å3 |
Cell temperature | 143 ± 2 K |
Ambient diffraction temperature | 143 ± 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 | 0.1116 |
Residual factor for significantly intense reflections | 0.055 |
Weighted residual factors for significantly intense reflections | 0.1014 |
Weighted residual factors for all reflections included in the refinement | 0.1305 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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