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Information card for entry 7112187
Preview
| Coordinates | 7112187.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C43 H29 Cl3 F6 N2 O6 S2 |
|---|---|
| Calculated formula | C43 H29 Cl3 F6 N2 O6 S2 |
| SMILES | ClC(Cl)Cl.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.[n+]1(c2c(c(C3=C(c4cccc5cccc3c45)c3c4ccccc4[n+](c4ccccc34)C)c3c1cccc3)cccc2)C |
| Title of publication | Preparation and structure of acenaphthylene-1,2-diyldi(9-acridine) derivatives with a long C[double bond, length as m-dash]C bond |
| Authors of publication | Takashi Takeda; Yasuto Uchimura; Hidetoshi Kawai; Ryo Katoono; Kenshu Fujiwara; Takanori Suzuki |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 3924 |
| a | 13.04 ± 0.003 Å |
| b | 13.546 ± 0.003 Å |
| c | 13.7353 ± 0.0013 Å |
| α | 67.069 ± 0.017° |
| β | 66.224 ± 0.016° |
| γ | 81.35 ± 0.02° |
| Cell volume | 2044.8 ± 0.8 Å3 |
| Cell temperature | 153 K |
| Ambient diffraction temperature | 153 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.0758 |
| Weighted residual factors for all reflections included in the refinement | 0.1024 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.911 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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