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Information card for entry 4026529
Preview
Coordinates | 4026529.cif |
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Original paper (by DOI) | HTML |
Formula | C50.5 H75.63 Cl4 N4.25 O28.44 |
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Calculated formula | C50.5 H74.75 Cl4 N4.25 O28.44 |
Title of publication | Synthesis, Structure, and Properties of Supramolecular Charge-Transfer Complexes between Bis(18-crown-6)stilbene and Ammonioalkyl Derivatives of 4,4'-Bipyridine and 2,7-Diazapyrene |
Authors of publication | Artem I. Vedernikov; Evgeny N. Ushakov; Asya A. Efremova; Lyudmila G. Kuz'mina; Anna A. Moiseeva; Natalia A. Lobova; Andrei V. Churakov; Yuri A. Strelenko; Michael V. Alfimov; Judith A. K. Howard; Sergey P. Gromov |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 6768 - 6779 |
a | 20.79 ± 0.003 Å |
b | 27.46 ± 0.004 Å |
c | 21.875 ± 0.003 Å |
α | 90° |
β | 90.096 ± 0.004° |
γ | 90° |
Cell volume | 12488 ± 3 Å3 |
Cell temperature | 120 ± 0.2 K |
Ambient diffraction temperature | 120 ± 0.2 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 | 0.1464 |
Residual factor for significantly intense reflections | 0.0715 |
Weighted residual factors for significantly intense reflections | 0.1694 |
Weighted residual factors for all reflections included in the refinement | 0.1944 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.875 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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