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Information card for entry 7156892
Preview
Coordinates | 7156892.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | RCS-21 |
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Formula | C11 H12 B F2 N O3 |
Calculated formula | C11 H12 B F2 N O3 |
Title of publication | BODIPY analogues: synthesis and photophysical studies of difluoro boron complexes from 2-aminotropone scaffolds through N,O-chelation. |
Authors of publication | Palai, Bibhuti Bhusana; Soren, Ramachandra; Sharma, Nagendra K. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 26 |
Pages of publication | 6497 - 6505 |
a | 13.1705 ± 0.0007 Å |
b | 12.9185 ± 0.0004 Å |
c | 7.3648 ± 0.0002 Å |
α | 90° |
β | 97.809 ± 0.003° |
γ | 90° |
Cell volume | 1241.45 ± 0.08 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 6 |
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 | 0.118 |
Residual factor for significantly intense reflections | 0.0974 |
Weighted residual factors for significantly intense reflections | 0.2898 |
Weighted residual factors for all reflections included in the refinement | 0.3107 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.2109 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
225120 (current) | 2019-11-08 | cif/ Updating files of 7156891, 7156892, 7156893, 7156894, 7156895, 7156896 Original log message: Adding full bibliography for 7156891--7156896.cif. |
7156892.cif |
215706 | 2019-06-05 | cif/ Adding structures of 7156891, 7156892, 7156893, 7156894, 7156895, 7156896 via cif-deposit CGI script. |
7156892.cif |
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Users of the data should acknowledge the original authors of the
structural data.