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CIF Information Card
Information card for 7101761
7101760 << 7101761 >> 7101762Preview
|
Coordinates |
7101761.cif |
Structure parameters
| Common name | compound 3 |
| Formula | - C32 H22 Cl4 N4 O4 - |
| Calculated formula | - C32 H22 Cl4 N4 O4 - |
| Title of publication | Oxacalixarenes and oxacyclophanes containing 1,8-naphthyridines: a new class of molecular tweezers with concave-surface functionality. |
| Authors of publication | Katz, Jeffrey L; Geller, Bram J; Foster, Peter D |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 10 |
| Pages of publication | 1026 - 1028 |
| a | 10.6659 ± 0.0009 Å |
| b | 16.1506 ± 0.0014 Å |
| c | 18.2407 ± 0.0016 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3142.2 ± 0.5 Å3 |
| Cell temperature | 174 ± 2 K |
| Ambient diffraction temperature | 174 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P n n m |
| Hall symmetry space group | -P 2 2n |
| Residual factor for all reflections | 0.0675 |
| Residual factor for observed reflections | 0.0567 |
| Weighted residual factors for the observed reflections | 0.1586 |
| Weighted residual factors for all reflections included in the refinement | 0.1685 |
| Goodness-of-fit parameter for observed reflections | 1.054 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |