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Information card for entry 7215466
Preview
| Coordinates | 7215466.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C156 H252 N12 O20 |
|---|---|
| Calculated formula | C156 H252 N12 O20 |
| Title of publication | Self-assembly patterns of steroid-based all-organic ferroelectrics: valuable insights from the single-crystals derived from an organogel and solution |
| Authors of publication | Asthana, Deepak; Keshri, Sudhir K.; Hundal, Geeta; Sharma, Gyaneswar; Mukhopadhyay, Pritam |
| Journal of publication | CrystEngComm |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 22 |
| Pages of publication | 4861 |
| a | 12.9772 ± 0.0003 Å |
| b | 14.3714 ± 0.0002 Å |
| c | 22.68 ± 0.0006 Å |
| α | 73.075 ± 0.001° |
| β | 79.981 ± 0.001° |
| γ | 69.56 ± 0.001° |
| Cell volume | 3779.49 ± 0.15 Å3 |
| Cell temperature | 123 ± 0.1 K |
| Ambient diffraction temperature | 123 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0824 |
| Residual factor for significantly intense reflections | 0.061 |
| Weighted residual factors for significantly intense reflections | 0.13 |
| Weighted residual factors for all reflections included in the refinement | 0.1427 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180485 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/54. |
7215466.cif |
| 116158 | 2014-06-07 | cif/ Updating files of 7215465, 7215466 Original log message: Adding full bibliography for 7215465--7215466.cif. |
7215466.cif |
| 112056 | 2014-04-29 | cif/ Adding structures of 7215465, 7215466 via cif-deposit CGI script. |
7215466.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.