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Information card for entry 2238601
Preview
Coordinates | 2238601.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | 1-(3,5-Dimethoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole |
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Formula | C19 H20 N2 O2 |
Calculated formula | C19 H20 N2 O2 |
SMILES | COc1cc(OC)cc(c1)n1c(nc(c1C)C)c1ccccc1 |
Title of publication | 1-(3,5-Dimethoxyphenyl)-4,5-dimethyl-2-phenyl-1<i>H</i>-imidazole |
Authors of publication | Divya, G.; Saravanan, K.; Santhiya, S.; Chandralekha, K.; Lakshmi, S. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 10 |
Pages of publication | o1502 |
a | 8.363 ± 0.005 Å |
b | 10.267 ± 0.005 Å |
c | 10.481 ± 0.005 Å |
α | 75.043 ± 0.005° |
β | 75.789 ± 0.005° |
γ | 74.576 ± 0.005° |
Cell volume | 822.9 ± 0.7 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0538 |
Residual factor for significantly intense reflections | 0.0416 |
Weighted residual factors for significantly intense reflections | 0.1152 |
Weighted residual factors for all reflections included in the refinement | 0.1262 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2238601.html
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