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Information card for entry 4113009
Preview
Coordinates | 4113009.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H18 N2 |
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Calculated formula | C22 H18 N2 |
SMILES | N(c1ccc(/C=C/c2ccccc2)cc1)(C)c1ccc(cc1)C#N |
Title of publication | Substituent-Dependent Photoinduced Intramolecular Charge Transfer in N-Aryl-Substituted trans-4-Aminostilbenes |
Authors of publication | Jye-Shane Yang; Kang-Ling Liau; Chin-Min Wang; Chung-Yu Hwang |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2004 |
Journal volume | 126 |
Pages of publication | 12325 - 12335 |
a | 9.6247 ± 0.0007 Å |
b | 9.7637 ± 0.0007 Å |
c | 18.7912 ± 0.0014 Å |
α | 85.592 ± 0.001° |
β | 81.797 ± 0.001° |
γ | 74.061 ± 0.001° |
Cell volume | 1679.3 ± 0.2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.201 |
Residual factor for significantly intense reflections | 0.1328 |
Weighted residual factors for significantly intense reflections | 0.2251 |
Weighted residual factors for all reflections included in the refinement | 0.2533 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.22 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4113009.html
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