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Information card for entry 1566375
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| Coordinates | 1566375.cif |
|---|---|
| Structure factors | 1566375.hkl |
| Original IUCr paper | HTML |
| Chemical name | 13,13'-Bi(dibenzo[<i>b</i>,<i>i</i>]fluorenylidene) |
|---|---|
| Formula | C42 H24 |
| Calculated formula | C42 H24 |
| SMILES | C1(c2c3ccccc3ccc2c2ccc3ccccc3c12)=C1c2c3ccccc3ccc2c2ccc3ccccc3c12 |
| Title of publication | 13,13'-Bi(dibenzo[<i>a</i>,<i>i</i>]fluorenylidene) |
| Authors of publication | Schollmeyer, Dieter; Detert, Heiner |
| Journal of publication | IUCrData |
| Year of publication | 2022 |
| Journal volume | 7 |
| Journal issue | 2 |
| Pages of publication | x220169 |
| a | 36.615 ± 0.0018 Å |
| b | 8.0709 ± 0.0003 Å |
| c | 36.282 ± 0.003 Å |
| α | 90° |
| β | 90.863 ± 0.005° |
| γ | 90° |
| Cell volume | 10720.7 ± 1.1 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 2 |
| 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 | 0.1459 |
| Residual factor for significantly intense reflections | 0.0723 |
| Weighted residual factors for significantly intense reflections | 0.182 |
| Weighted residual factors for all reflections included in the refinement | 0.2281 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273020 (current) | 2022-02-18 | cif/ hkl/ Adding structures of 1566375 via cif-deposit CGI script. |
1566375.cif 1566375.hkl |
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Users of the data should acknowledge the original authors of the
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