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Information card for entry 2020835
Preview
Coordinates | 2020835.cif |
---|---|
Structure factors | 2020835.hkl |
Original IUCr paper | HTML |
Chemical name | 4-Fluoro-1,1'-biphenyl |
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Formula | C12 H9 F |
Calculated formula | C12 H9 F |
Title of publication | Intricacies of ligand coordination in tricarbonylchromium(0) complexes with <i>ortho</i>- and <i>para</i>-fluorobiphenyls |
Authors of publication | Guzei, Ilia A.; Spencer, Lara C.; Buechel, Sondra C.; Kaufmann, Leah B.; Czerwinski, Curtis J. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2017 |
Journal volume | 73 |
Journal issue | 8 |
a | 12.9824 ± 0.0009 Å |
b | 23.0588 ± 0.0015 Å |
c | 5.7527 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1722.1 ± 0.2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100.02 K |
Number of distinct elements | 3 |
Space group number | 43 |
Hermann-Mauguin space group symbol | F d d 2 |
Hall space group symbol | F 2 -2d |
Residual factor for all reflections | 0.0387 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.1062 |
Weighted residual factors for all reflections included in the refinement | 0.1066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
199383 (current) | 2017-07-28 | cif/ hkl/ Adding structures of 2020833, 2020834, 2020835, 2020836 via cif-deposit CGI script. |
2020835.cif 2020835.hkl |
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Users of the data should acknowledge the original authors of the
structural data.