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CIF Information Card
Information card for 1000000
9016730 << 1000000 >> 1000001Preview
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Coordinates |
1000000.cif |
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Original IUCr paper |
HTML |
Structure parameters
| Formula | - C5 H17 Al N2 O8 P2 - |
| Calculated formula | - C5 H17 Al N2 O8 P2 - |
| Title of publication | [H~3~N(CH~2~)~5~NH~3~].AlP~2~O~8~H, a one-dimensional aluminophosphate |
| Authors of publication | Phan Thanh, S.; Marrot, J.; Renaudin, J.; Maisonneuve, V. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 9 |
| Pages of publication | 1073 - 1074 |
| a | 7.8783 ± 0.0002 Å |
| b | 10.4689 ± 0.0001 Å |
| c | 16.068 ± 0.0004 Å |
| α | 90° |
| β | 95.147 ± 0.001° |
| γ | 90° |
| Cell volume | 1319.9 ± 0.05 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.1073 |
| Residual factor for observed reflections | 0.0584 |
| Weighted residual factors for all reflections | 0.2069 |
| Weighted residual factors for all reflections included in the refinement | 0.1362 |
| Goodness-of-fit parameter for all reflections | 1.055 |
| Goodness-of-fit parameter for observed reflections | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Dublicate of | 2011331 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |