Information card for entry 7100826

Structure parameters

• Formula: C24 H24 I3 S16
• Calculated formula: C24 H24 I3 S16
• SMILES: I[I-]I.S1CCCSC1=C1[S+]C2SC(=C3SCCCS3)SC=2S1.S1CCCSC1=C1SC2SC(=C3SCCCS3)SC=2S1
• Title of publication: Pressure effect on the electrical conductivity and superconductivity of beta-(BDA-TTP)2I3
• Authors of publication: Jun-ichi Yamada; Masashi Aimatsu; Hiroki Akutsu; Toshiaki Enoki; Kazuya Fujimoto; Koichi Kikuchi; S. Kudo; Akira Miyazaki; Shinichi Nakatsuji
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 9.246 ± 0.0009 Å
• b: 16.792 ± 0.002 Å
• c: 6.495 ± 0.0007 Å
• α: 95.263 ± 0.009°
• β: 106.576 ± 0.008°
• γ: 95.766 ± 0.009°
• Cell volume: 953.9 ± 0.2 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 4
• 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