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Information card for entry 4031889
Preview
Coordinates | 4031889.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H24 |
---|---|
Calculated formula | C30 H24 |
SMILES | C12(CCC3(CC1)c1ccccc1c1c3cccc1)c1ccccc1c1c2cccc1 |
Title of publication | From Wires to Cables: Attempted Synthesis of 1,3,5-Trifluorenylcyclohexane as a Platform for Molecular Cables. |
Authors of publication | Talipov, Marat R.; Abdelwahed, Sameh H.; Thakur, Khushabu; Reid, Scott A.; Rathore, Rajendra |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2016 |
Journal volume | 81 |
Journal issue | 4 |
Pages of publication | 1627 - 1634 |
a | 17.2175 ± 0.0005 Å |
b | 6.92 ± 0.0002 Å |
c | 17.2064 ± 0.0005 Å |
α | 90° |
β | 92.311 ± 0.001° |
γ | 90° |
Cell volume | 2048.39 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 2 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0283 |
Residual factor for significantly intense reflections | 0.0281 |
Weighted residual factors for significantly intense reflections | 0.0722 |
Weighted residual factors for all reflections included in the refinement | 0.0724 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4031889.html
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Users of the data should acknowledge the original authors of the
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