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Information card for entry 7233562
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| Coordinates | 7233562.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | dabco hydrochloride |
|---|---|
| Chemical name | 1,4diazabicyclo[2.2.2]octane hydrochloride |
| Formula | C6 H13 Cl N2 |
| Calculated formula | C6 H13 Cl N2 |
| Title of publication | Strong negative thermal expansion and relaxor ferroelectricity driven by supramolecular patterns |
| Authors of publication | Marek Szafranski |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2012 |
| Journal volume | 1 |
| Pages of publication | 7904 - 7913 |
| a | 7.368 ± 0.006 Å |
| b | 10.076 ± 0.002 Å |
| c | 10.227 ± 0.005 Å |
| α | 90 ± 0.04° |
| β | 90 ± 0.06° |
| γ | 90 ± 0.06° |
| Cell volume | 759.3 ± 0.7 Å3 |
| Cell temperature | 295 ± 1 K |
| Ambient diffraction temperature | 295 ± 1 K |
| Number of distinct elements | 4 |
| Space group number | 36 |
| Hermann-Mauguin space group symbol | C m c 21 |
| Hall space group symbol | C 2c -2 |
| Residual factor for all reflections | 0.0324 |
| Residual factor for significantly intense reflections | 0.0257 |
| Weighted residual factors for significantly intense reflections | 0.0708 |
| Weighted residual factors for all reflections included in the refinement | 0.0731 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217841 (current) | 2019-08-29 | cif/ Adding structures of 7233562 via cif-deposit CGI script. |
7233562.cif |
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Users of the data should acknowledge the original authors of the
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