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Information card for entry 7049123
Preview
| Coordinates | 7049123.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C18 H26 I N2 P |
|---|---|
| Calculated formula | C18 H26 I N2 P |
| Title of publication | Hydrogen-bonded organo-amino phosphonium halides: dielectric, piezoelectric and possible ferroelectric properties. |
| Authors of publication | Vijayakanth, Thangavel; Pandey, Richa; Kulkarni, Priyangi; Praveenkumar, Balu; Kabra, Dinesh; Boomishankar, Ramamoorthy |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 21 |
| Pages of publication | 7331 - 7336 |
| a | 9.602 ± 0.01 Å |
| b | 15.137 ± 0.015 Å |
| c | 13.562 ± 0.015 Å |
| α | 90° |
| β | 92.026 ± 0.019° |
| γ | 90° |
| Cell volume | 1970 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.032 |
| Residual factor for significantly intense reflections | 0.0279 |
| Weighted residual factors for significantly intense reflections | 0.0578 |
| Weighted residual factors for all reflections included in the refinement | 0.0595 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7049123.cif |
| 224445 | 2019-11-08 | cif/ Updating files of 7049122, 7049123, 7049124, 7049125, 7049126, 7049127, 7049128, 7049129 Original log message: Adding full bibliography for 7049122--7049129.cif. |
7049123.cif |
| 213802 | 2019-02-23 | cif/ Adding structures of 7049122, 7049123, 7049124, 7049125, 7049126, 7049127, 7049128, 7049129 via cif-deposit CGI script. |
7049123.cif |
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Users of the data should acknowledge the original authors of the
structural data.