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Information card for entry 1571470
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| Coordinates | 1571470.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | Ethidium benzoate methanol monosolvate |
|---|---|
| Chemical name | 8-Amino-5-ethyl-6-phenylphenanthridin-5-ium benzoate methanol monosolvate |
| Formula | C29 H29 N3 O3 |
| Calculated formula | C29 H29 N3 O3 |
| Title of publication | Ethidium benzoate methanol monosolvate |
| Authors of publication | Shimazaki, Runa; Sadakiyo, Masaaki |
| Journal of publication | IUCrData |
| Year of publication | 2024 |
| Journal volume | 9 |
| Journal issue | 4 |
| a | 22.0407 ± 0.0006 Å |
| b | 12.4642 ± 0.0003 Å |
| c | 18.0706 ± 0.0005 Å |
| α | 90° |
| β | 107.495 ± 0.001° |
| γ | 90° |
| Cell volume | 4734.7 ± 0.2 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0688 |
| Residual factor for significantly intense reflections | 0.0532 |
| Weighted residual factors for significantly intense reflections | 0.139 |
| Weighted residual factors for all reflections included in the refinement | 0.1504 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291294 (current) | 2024-04-19 | cif/ Adding structures of 1571470 via cif-deposit CGI script. |
1571470.cif |
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Users of the data should acknowledge the original authors of the
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