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CIF Information Card
Information card for 2015345
2015344 << 2015345 >> 2015346Preview
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Coordinates |
2015345.cif |
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Structure factors |
2015345.hkl |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | Ferrocene--decafluorobiphenyl (1/1) |
| Formula | - C22 H10 F10 Fe - |
| Calculated formula | - C22 H10 F10 Fe - |
| Title of publication | Arene‒perfluoroarene interactions in crystal engineering. 15. Ferrocene‒decafluorobiphenyl (1/1) |
| Authors of publication | Batsanov, Andrei S.; Collings, Jonathan C.; Marder, Todd B. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 6 |
| Pages of publication | m229 - m231 |
| a | 13.3025 ± 0.0012 Å |
| b | 6.169 ± 0.0006 Å |
| c | 23.026 ± 0.002 Å |
| α | 90° |
| β | 98.69 ± 0.01° |
| γ | 90° |
| Cell volume | 1867.9 ± 0.3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | C 1 2/c 1 |
| Hall symmetry space group | -C 2yc |
| Residual factor for all reflections | 0.0536 |
| Residual factor for observed reflections | 0.0389 |
| Weighted residual factors for the observed reflections | 0.0911 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for observed reflections | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |