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Information card for entry 2223364
Preview
Coordinates | 2223364.cif |
---|---|
Structure factors | 2223364.hkl |
Original IUCr paper | HTML |
Chemical name | <i>N</i>^1^,<i>N</i>^2^-Bis(2,6-dimethylphenyl)-<i>N</i>^1^-hydroxyformamidine <i>N</i>,<i>N</i>'-bis(2,6-dimethylphenyl)-<i>N</i>-oxidoformamidinium dichloromethane solvate |
---|---|
Formula | C35 H42 Cl2 N4 O2 |
Calculated formula | C35 H42 Cl2 N4 O2 |
SMILES | ClCCl.O=N(=CNc1c(cccc1C)C)c1c(cccc1C)C.ON(/C=N/c1c(cccc1C)C)c1c(cccc1C)C |
Title of publication | <i>N</i>^1^,<i>N</i>^2^-Bis(2,6-dimethylphenyl)-<i>N</i>^1^-hydroxyformamidine <i>N</i>,<i>N</i>'-bis(2,6-dimethylphenyl)-<i>N</i>-oxidoformamidinium dichloromethane solvate |
Authors of publication | Cibian, Mihaela; Derossi, Sofia; Hanan, Garry S. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 10 |
Pages of publication | o2485 |
a | 16.36 ± 0.005 Å |
b | 18.137 ± 0.006 Å |
c | 11.421 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3388.9 ± 1.9 Å3 |
Cell temperature | 200 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 5 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0809 |
Residual factor for significantly intense reflections | 0.0485 |
Weighted residual factors for significantly intense reflections | 0.1173 |
Weighted residual factors for all reflections included in the refinement | 0.1356 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2223364.html
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