Information card for entry 7100923

Structure parameters

• Formula: C23 H14 F6 O2 S2
• Calculated formula: C23 H14 F6 O2 S2
• SMILES: S1(=O)(=O)C(=C(c2c1cccc2)C1=C(C(F)(F)C(F)(F)C1(F)F)c1c2ccccc2sc1C)C
• Title of publication: Fatigue-resistant photochromic dithienylethenes by controlling the oxidation state
• Authors of publication: Sung Yang.; Kwang-Hyun Ahn.; Yong-Chul Jeong.; Eunkyoung Kim.
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 8.1239 ± 0.0014 Å
• b: 10.7442 ± 0.0019 Å
• c: 13.125 ± 0.002 Å
• α: 86.419 ± 0.015°
• β: 76.057 ± 0.013°
• γ: 74.297 ± 0.013°
• Cell volume: 1070.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No