Information card for entry 2001633

Structure parameters

• Formula: C12 H14 F6 P S2 Se2
• Calculated formula: C12 H12 F6 P S2 Se2
• Title of publication: Structures of 3,4-dimethyl-2,2',5,5'-tetrathiafulvalene perrhenate, (DMTTF)ReO~4~, and 3',4'-dimethyl-3,4-tetramethylene-2,5-dithia-2',5'-diselenafulvalene hexafluorophosphate, (CHDTDMDSF)PF~6~
• Authors of publication: Mhanni, A.; Ouahab, L.; Grandjean, D.; Amouroux, J.; Fabre, J. M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 6
• Pages of publication: 1187 - 1189
• a: 9.682 ± 0.014 Å
• b: 9.698 ± 0.004 Å
• c: 9.926 ± 0.002 Å
• α: 81.95 ± 0.03°
• β: 80.84 ± 0.05°
• γ: 68.36 ± 0.07°
• Cell volume: 851.9 ± 1.4 ų
• Cell temperature: 293 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 significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.071
• Goodness-of-fit parameter for significantly intense reflections: 1.617
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No