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Information card for entry 2216979
Preview
Coordinates | 2216979.cif |
---|---|
Structure factors | 2216979.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[diazidomanganese(II)]bis[μ-1-(4-pyridylmethyl)- 1<i>H</i>-benzimidazole]] |
---|---|
Formula | C26 H22 Mn N12 |
Calculated formula | C26 H22 Mn N12 |
SMILES | [Mn]1(N=N#N)(N=N#N)([n]2cn(c3c2cccc3)Cc2cc[n](cc2)[Mn](N=N#N)(N=N#N)[n]2cn(c3c2cccc3)Cc2cc[n]1cc2)([n]1ccc(cc1)Cn1cnc2c1cccc2)[n]1cn(c2c1cccc2)Cc1ccncc1 |
Title of publication | <i>catena</i>-Poly[[diazidomanganese(II)]bis[μ-1-(4-pyridylmethyl)-1<i>H</i>-benzimidazole]] |
Authors of publication | Chun-Sen Liu; Jun-Jie Wang; Li-Fen Yan |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2008 |
Journal volume | 64 |
Journal issue | 1 |
Pages of publication | m29 - m30 |
a | 8.4135 ± 0.0017 Å |
b | 8.5823 ± 0.0017 Å |
c | 10.399 ± 0.002 Å |
α | 67.86 ± 0.03° |
β | 86.03 ± 0.03° |
γ | 69.8 ± 0.03° |
Cell volume | 651.1 ± 0.3 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0303 |
Residual factor for significantly intense reflections | 0.0288 |
Weighted residual factors for significantly intense reflections | 0.0801 |
Weighted residual factors for all reflections included in the refinement | 0.0811 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2216979.html
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Users of the data should acknowledge the original authors of the
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