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Information card for entry 7059658
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Coordinates | 7059658.cif |
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Original paper (by DOI) | HTML |
Common name | no |
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Chemical name | dianion salt of flavanthrone with tetrabutylphosphonium cations |
Formula | C60 H84 N2 O2 P2 |
Calculated formula | C60 H84 N2 O2 P2 |
Title of publication | Flavanthrone ‒ a new ligand with accessible radical anion and dianion states: preparation of zwitterionic {(Cp2V)2(flavanthrone)} and {(Cp2V)2(chloranil)} complexes |
Authors of publication | Konarev, Dmitri V.; Andronov, Mikhail G.; Batov, Mikhail S.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Shestakov, Alexander F.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2020 |
Journal volume | 44 |
Journal issue | 26 |
Pages of publication | 10849 - 10858 |
a | 10.0315 ± 0.0005 Å |
b | 11.165 ± 0.0005 Å |
c | 12.4225 ± 0.0006 Å |
α | 80.1 ± 0.004° |
β | 73.741 ± 0.005° |
γ | 87.212 ± 0.004° |
Cell volume | 1315.81 ± 0.11 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 8 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1089 |
Residual factor for significantly intense reflections | 0.0705 |
Weighted residual factors for significantly intense reflections | 0.155 |
Weighted residual factors for all reflections included in the refinement | 0.1795 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7059658.html
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