Information card for entry 7100574

Structure parameters

• Common name: PhBPTSEt
• Formula: C13 H10 N3 S2 Se2
• Calculated formula: C13 H10 N3 S2 Se2
• Title of publication: The effect of selenium incorporation on the bandwidth and conductivity of neutral radical conductors
• Authors of publication: Richard Oakley; Leanne Beer; Jaclyn L. Brusso; Robert C. Haddon; Mikhail E. Itkis; Robert W. Reed; J.F.Richardson; Richard Secco; Xueyang Yu.
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 15.733 ± 0.006 Å
• b: 15.733 ± 0.006 Å
• c: 4.973 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1066 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 154
• Hermann-Mauguin space group symbol: P 32 2 1
• Hall space group symbol: P 32 2"
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No