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Information card for entry 7238219
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Coordinates | 7238219.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Phenylmethanamine |
---|---|
Chemical name | Phenylmethanamine |
Formula | C7 H9 N |
Calculated formula | C7 H9 N |
Title of publication | Directing role of functional groups in selective generation of C‒H⋯π interactions: In situ cryo-crystallographic studies on benzyl derivatives |
Authors of publication | Nayak, Susanta K.; Sathishkumar, Ranganathan; Row, T. N. Guru |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 10 |
Pages of publication | 3112 |
a | 10.623 ± 0.003 Å |
b | 10.623 ± 0.003 Å |
c | 5.5031 ± 0.0018 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 621 ± 0.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 3 |
Space group number | 78 |
Hermann-Mauguin space group symbol | P 43 |
Hall space group symbol | P 4cw |
Residual factor for all reflections | 0.0449 |
Residual factor for significantly intense reflections | 0.0331 |
Weighted residual factors for significantly intense reflections | 0.079 |
Weighted residual factors for all reflections included in the refinement | 0.0837 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
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/7238219.html
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Users of the data should acknowledge the original authors of the
structural data.