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CIF Information Card
Information card for 7205833
7205832 << 7205833 >> 7205834Preview
|
Coordinates |
7205833.cif |
Structure parameters
| Formula | - C12 H28 N8 O4 - |
| Calculated formula | - C12 H28 N8 O4 - |
| Title of publication | The azide anion as a building block in crystal engineering from a charge density point of view |
| Authors of publication | Bushmarinov, Ivan S.; Nabiev, Orudzh G.; Kostyanovsky, Remir G.; Antipin, Mikhail Yu.; Lyssenko, Konstantin A. |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 8 |
| Pages of publication | 2930 |
| a | 7.6036 ± 0.0001 Å |
| b | 8.548 ± 0.0001 Å |
| c | 13.8275 ± 0.0002 Å |
| α | 90° |
| β | 90.3164 ± 0.0007° |
| γ | 90° |
| Cell volume | 898.71 ± 0.02 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.074 |
| Residual factor for observed reflections | 0.0401 |
| Weighted residual factors for the observed reflections | 0.1021 |
| Weighted residual factors for all reflections included in the refinement | 0.1222 |
| Goodness-of-fit parameter for observed reflections | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |