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Information card for entry 8102694
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Coordinates | 8102694.cif |
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Chemical name | atena-poly[[(bis(1,3,5-tris(1-imidazolyl)benzene))zinc(II) monohydrate]bis(perchlorate)], [Zn(C~15~H~12~N~6~)~2~(H~2~O)]~n~.2(ClO~4~) |
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Formula | C30 H26 Cl2 N12 O9 Zn |
Calculated formula | C30 H26 Cl2 N12 O9 Zn |
Title of publication | Crystal structure of catena-aqua(bis(1,3,5-tris(1-imidazolyl)benzene))zinc(II) perchlorate, [Zn(C15H12N6)2(H2O)](ClO4)2 |
Authors of publication | Yi-Fang Deng |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2010 |
Journal volume | 225 |
Journal issue | 2 |
Pages of publication | 331 |
a | 21.2333 ± 0.0009 Å |
b | 21.2333 ± 0.0009 Å |
c | 15.1649 ± 0.0013 Å |
α | 90° |
β | 90 ± 0.001° |
γ | 90° |
Cell volume | 6837.1 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 120 |
Hermann-Mauguin space group symbol | I -4 c 2 |
Hall space group symbol | I -4 -2c |
Residual factor for all reflections | 0.0707 |
Residual factor for significantly intense reflections | 0.061 |
Weighted residual factors for significantly intense reflections | 0.144 |
Weighted residual factors for all reflections included in the refinement | 0.1505 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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