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Information card for entry 7050265
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7050265.cif |
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Formula | C12 H8 Br2 Cu I0 N2 |
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Calculated formula | C12 H8 Br2 Cu N2 |
Title of publication | Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand |
Authors of publication | Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang |
Journal of publication | New J.Chem.(Nouv.J.Chim.) |
Year of publication | 2004 |
a | 9.945 ± 0.002 Å |
b | 6.5064 ± 0.0013 Å |
c | 18.222 ± 0.004 Å |
α | 90° |
β | 91.23 ± 0.03° |
γ | 90° |
Cell volume | 1178.8 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0479 |
Residual factor for significantly intense reflections | 0.0285 |
Weighted residual factors for significantly intense reflections | 0.06 |
Weighted residual factors for all reflections included in the refinement | 0.0642 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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