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Information card for entry 7247841
Preview
Coordinates | 7247841.cif |
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Original paper (by DOI) | HTML |
Formula | C19 H15 N3 O |
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Calculated formula | C19 H15 N3 O |
SMILES | O=C(N/N=C/c1ccc(c2ccccc2)cc1)c1ncccc1 |
Title of publication | Dual control of passive light output direction by light and mechanical forces in elastic crystals |
Authors of publication | Han, Chuchu; Yang, Jing; Zhang, Xin; Li, Aisen; Peng, Jiang |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 2 |
Pages of publication | 203 - 208 |
a | 12.4347 ± 0.0005 Å |
b | 7.204 ± 0.0003 Å |
c | 33.7027 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3019.1 ± 0.2 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.069 |
Residual factor for significantly intense reflections | 0.0539 |
Weighted residual factors for significantly intense reflections | 0.1338 |
Weighted residual factors for all reflections included in the refinement | 0.149 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
289449 (current) | 2024-02-04 | cif/ Updating files of 7247841 Original log message: Adding full bibliography for 7247841.cif. |
7247841.cif |
288104 | 2023-12-07 | cif/ Adding structures of 7247841 via cif-deposit CGI script. |
7247841.cif |
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