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Information card for entry 7205192
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Coordinates | 7205192.cif |
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Original paper (by DOI) | HTML |
Common name | 1,4-bis(2-(1-methyl-pyridinium-4-yl)vinyl)benzene di-4- methylbenzenesulphonate dihydrate |
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Formula | C36 H40 N2 O7 S2 |
Calculated formula | C36 H40 N2 O8 S2 |
Title of publication | Luminescence induced by strong cation‒anion π‒π interactions in crystals of viologen analogues |
Authors of publication | Gutov, Oleksii V.; Rusanov, Eduard B.; Kudryavtsev, Alexey A.; Garasevych, Sergey G.; Slobodyanyuk, Olexandr V.; Yashchuk, Valerii M.; Chernega, Alexander N. |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 5 |
Pages of publication | 1373 |
a | 8.9032 ± 0.0011 Å |
b | 18.99 ± 0.002 Å |
c | 9.9994 ± 0.0011 Å |
α | 90° |
β | 92.093 ± 0.005° |
γ | 90° |
Cell volume | 1689.5 ± 0.3 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/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0676 |
Residual factor for significantly intense reflections | 0.043 |
Weighted residual factors for significantly intense reflections | 0.0958 |
Weighted residual factors for all reflections included in the refinement | 0.1104 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.979 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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