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Information card for entry 7204059
Preview
Coordinates | 7204059.cif |
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Original paper (by DOI) | HTML |
Common name | (BPT-TSF)2AsF6 |
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Formula | C24 H24 As F6 S4 Se8 |
Calculated formula | C25.8 As F6 S3.32 Se8 |
Title of publication | Synthesis and properties of novel heterocycle-fused TTF-type electron donors: bis(propylenethio)tetrathiafulvalene (BPT-TTF), bis(propyleneseleno)tetrathiafulvalene (BPS-TTF), and their tetraselenafulvalene analogues (BPT-TSF and BPS-TSF) |
Authors of publication | Jigami, Tetsuya; Kodani, Mie; Murakami, Satoshi; Takimiya, Kazuo; Aso, Yoshio; Otsubo, Tetsuo |
Journal of publication | Journal of Materials Chemistry |
Year of publication | 2001 |
Journal volume | 11 |
Journal issue | 4 |
Pages of publication | 1026 |
a | 7.891 ± 0.006 Å |
b | 16.406 ± 0.005 Å |
c | 6.629 ± 0.003 Å |
α | 96.09 ± 0.03° |
β | 100.43 ± 0.05° |
γ | 87.1 ± 0.05° |
Cell volume | 838.8 ± 0.8 Å3 |
Cell temperature | 296.2 K |
Ambient diffraction temperature | 296.2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0326 |
Residual factor for significantly intense reflections | 0.0326 |
Weighted residual factors for significantly intense reflections | 0.034 |
Weighted residual factors for all reflections included in the refinement | 0.034 |
Goodness-of-fit parameter for all reflections included in the refinement | 3.303 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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