Information card for entry 7063298

Structure parameters

• Chemical name: (1,1,2,2,3,3,4,7-octafluoro-2,3-dihydro-1H-indene-5,6-diyl) bis(benzylsulfane)
• Formula: C23 H14 F8 S2
• Calculated formula: C23 H14 F8 S2
• Title of publication: Synthesis, structural peculiarities, and photosensitivity of fluorinated dibenzo-1,2,5,6-tetrathiocines
• Authors of publication: Buravlev, Alexander A.; Makarov, Alexander Yu.; Salnikov, Georgy E.; Genaev, Alexander M.; Bagryanskaya, Irina Yu.; Nikulshin, Pavel V.; Platonov, Vyacheslav E.; Zibarev, Andrey V.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• Journal volume: 48
• Journal issue: 28
• Pages of publication: 12807 - 12816
• a: 9.0063 ± 0.0005 Å
• b: 9.107 ± 0.0005 Å
• c: 13.7547 ± 0.0007 Å
• α: 101.99 ± 0.002°
• β: 101.874 ± 0.002°
• γ: 93.494 ± 0.002°
• Cell volume: 1073.59 ± 0.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1257
• Weighted residual factors for all reflections included in the refinement: 0.1372
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No