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Information card for entry 7712972
Preview
| Coordinates | 7712972.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H20 Br N3 O |
|---|---|
| Calculated formula | C26 H20 Br N3 O |
| Title of publication | 2-Hydroxyphenyl Benzimidazoles and their Boron Complexes: Synthesis, Structure, Aggregation-Induced Emission and Picric acid Sensing |
| Authors of publication | Arumugam, Ramar; Nayak, Prakash; Dey, Bijoy; Kannan, Ramkumar; Venkatasubbaiah, Krishnan; Chandrasekhar, Vadapalli |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 20.935 ± 0.0017 Å |
| b | 13.2912 ± 0.0008 Å |
| c | 17.0064 ± 0.001 Å |
| α | 90° |
| β | 113.317 ± 0.008° |
| γ | 90° |
| Cell volume | 4345.6 ± 0.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1324 |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for significantly intense reflections | 0.1094 |
| Weighted residual factors for all reflections included in the refinement | 0.1327 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.99 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283602 (current) | 2023-05-09 | cif/ Adding structures of 7712968, 7712969, 7712970, 7712971, 7712972, 7712973, 7712974, 7712975, 7712976, 7712977 via cif-deposit CGI script. |
7712972.cif |
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Users of the data should acknowledge the original authors of the
structural data.