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Information card for entry 4348000
Preview
Coordinates | 4348000.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C13 H14 N2 O |
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Calculated formula | C13 H14 N2 O |
SMILES | O=C1N(C(=N/C1=C\c1cccc(c1)C)C)C |
Title of publication | Photophysics, Dynamics, and Energy Transfer in Rigid Mimics of GFP-based Systems. |
Authors of publication | Dolgopolova, Ekaterina A.; Rice, Allison M.; Smith, Mark D.; Shustova, Natalia B. |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 15 |
Pages of publication | 7257 - 7264 |
a | 7.5769 ± 0.0002 Å |
b | 21.9043 ± 0.0007 Å |
c | 7.5614 ± 0.0002 Å |
α | 90° |
β | 118.253 ± 0.001° |
γ | 90° |
Cell volume | 1105.43 ± 0.06 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0433 |
Residual factor for significantly intense reflections | 0.0373 |
Weighted residual factors for significantly intense reflections | 0.0974 |
Weighted residual factors for all reflections included in the refinement | 0.1015 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation probe | x-ray |
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/4348000.html
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