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Information card for entry 1508484
Preview
Coordinates | 1508484.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H30 Cl2 F12 P2 S10 Se8 |
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Calculated formula | C40 H30.01 Cl1.99 F12 P2 S10 Se8 |
Title of publication | Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene |
Authors of publication | Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji |
Journal of publication | Crystals |
Year of publication | 2012 |
Journal volume | 2 |
Journal issue | 3 |
Pages of publication | 1092 - 1107 |
a | 12.666 ± 0.003 Å |
b | 14.299 ± 0.004 Å |
c | 16.289 ± 0.005 Å |
α | 85.39 ± 0.02° |
β | 88.219 ± 0.019° |
γ | 79.788 ± 0.018° |
Cell volume | 2893.6 ± 1.4 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 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 all reflections | 0.1263 |
Residual factor for significantly intense reflections | 0.0745 |
Weighted residual factors for significantly intense reflections | 0.2084 |
Weighted residual factors for all reflections included in the refinement | 0.2674 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.974 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/1508484.html
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