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Information card for entry 2012282
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| Coordinates | 2012282.cif |
|---|---|
| Structure factors | 2012282.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(N-octylsalicylideneaminato-N,O)copper(II) |
|---|---|
| Formula | C30 H44 Cu N2 O2 |
| Calculated formula | C30 H44 Cu N2 O2 |
| SMILES | C(CCCCCCC)[N]1=Cc2c(O[Cu]31[N](CCCCCCCC)=Cc1c(O3)cccc1)cccc2 |
| Title of publication | Bis(<i>N</i>-octylsalicylideniminato-<i>N</i>,<i>O</i>)copper(II) |
| Authors of publication | Zhang, Lei Z.; Bu, Ping-Yu; Wang, Li-Juan; Cheng, Peng |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 10 |
| Pages of publication | 1166 - 1167 |
| a | 16.571 ± 0.004 Å |
| b | 9.742 ± 0.003 Å |
| c | 9.5 ± 0.003 Å |
| α | 90° |
| β | 101.507 ± 0.005° |
| γ | 90° |
| Cell volume | 1502.8 ± 0.8 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.108 |
| Residual factor for significantly intense reflections | 0.048 |
| Weighted residual factors for all reflections included in the refinement | 0.126 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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