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Information card for entry 8102245
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Coordinates | 8102245.cif |
---|
Formula | C12 H44 Cu N10 O16 |
---|---|
Calculated formula | C12 H44 Cu N10 O16 |
Title of publication | Crystal structure of hexaaquacopper(II) dinitrate hexamethylene-tetramine tetrahydrate, [Cu(H2O)6][NO3]2(N4C6H12)2 · 4H2O |
Authors of publication | Xin-Hua Liu; Qin Lu; Lei Zhang; Lei Shi |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2008 |
Journal volume | 223 |
Journal issue | 2 |
Pages of publication | 117 |
a | 9.105 ± 0.004 Å |
b | 9.35 ± 0.004 Å |
c | 9.7 ± 0.004 Å |
α | 87.743 ± 0.005° |
β | 75.674 ± 0.004° |
γ | 61.248 ± 0.005° |
Cell volume | 698.4 ± 0.5 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 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 | 0.0722 |
Residual factor for significantly intense reflections | 0.0687 |
Weighted residual factors for significantly intense reflections | 0.1857 |
Weighted residual factors for all reflections included in the refinement | 0.1904 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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