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Information card for entry 7131051
Preview
| Coordinates | 7131051.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C118 H36 Cl20 F50 S10 Sb2 |
|---|---|
| Calculated formula | C118 H36 Cl20 F50 S10 Sb2 |
| Title of publication | Topoisomers and aromaticity of a redox active 50π core-modified isophlorinoid. |
| Authors of publication | Udaya, Hosahalli S.; Basavarajappa, Ashokkumar; Gopalakrishna, Tullimilli Y.; Anand, Venkataramanarao G. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2022 |
| a | 13.852 ± 0.004 Å |
| b | 15.004 ± 0.005 Å |
| c | 18.787 ± 0.006 Å |
| α | 81.29 ± 0.008° |
| β | 69.677 ± 0.008° |
| γ | 70.253 ± 0.008° |
| Cell volume | 3443.6 ± 1.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1083 |
| Residual factor for significantly intense reflections | 0.0561 |
| Weighted residual factors for significantly intense reflections | 0.1161 |
| Weighted residual factors for all reflections included in the refinement | 0.1415 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279629 (current) | 2022-11-30 | cif/ Adding structures of 7131049, 7131050, 7131051, 7131052 via cif-deposit CGI script. |
7131051.cif |
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