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Information card for entry 2200661
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| Coordinates | 2200661.cif |
|---|---|
| Structure factors | 2200661.hkl |
| Original IUCr paper | HTML |
| Chemical name | N,N'-bis(4-cyanopyridylidene)benzil dihydrazone |
|---|---|
| Formula | C30 H20 N6 |
| Calculated formula | C30 H20 N6 |
| SMILES | N(N=Cc1ccc(cc1)C#N)=C(C(=NN=Cc1ccc(cc1)C#N)c1ccccc1)c1ccccc1 |
| Title of publication | <i>N,N</i>'-Bis(4-cyanopyridylidene)benzil dihydrazone |
| Authors of publication | Goutam Kumar Patra; Israel Goldberg |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 10 |
| Pages of publication | o988 - o989 |
| a | 9.443 ± 0.0003 Å |
| b | 10.139 ± 0.0003 Å |
| c | 14.138 ± 0.0007 Å |
| α | 96.023 ± 0.001° |
| β | 95.676 ± 0.001° |
| γ | 112.223 ± 0.002° |
| Cell volume | 1231.94 ± 0.08 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1383 |
| Residual factor for significantly intense reflections | 0.0561 |
| Weighted residual factors for all reflections included in the refinement | 0.1536 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.972 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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