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Information card for entry 2209306
Preview
Coordinates | 2209306.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | N-(3-Thienylmethyl)-1,8-naphthalimide |
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Formula | C17 H11 N O2 S |
Calculated formula | C17 H11 N O2 S |
SMILES | O=C1c2cccc3c2c(C(=O)N1Cc1cscc1)ccc3 |
Title of publication | <i>N</i>-(3-Thienylmethyl)-1,8-naphthalimide |
Authors of publication | Yu-Quan, Shi; Bin Chen |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 6 |
Pages of publication | o2200 - o2201 |
a | 8.6904 ± 0.0015 Å |
b | 13.096 ± 0.002 Å |
c | 11.59 ± 0.002 Å |
α | 90° |
β | 93.961 ± 0.003° |
γ | 90° |
Cell volume | 1315.9 ± 0.4 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0644 |
Residual factor for significantly intense reflections | 0.0357 |
Weighted residual factors for significantly intense reflections | 0.0831 |
Weighted residual factors for all reflections included in the refinement | 0.0972 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2209306.html
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