Information card for entry 4100474

Structure parameters

• Formula: C92.5 H66 Cl9 F8 Fe2 N4 O8
• Calculated formula: C92.5 H64 Cl9 F8 Fe2 N4 O8
• Authors of publication: Lambert, C.; Schelter, J.; Amthor, S.; Coropceanu, V.; Brédas, J.-L.; Gruhn, N. E.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 14.624 ± 0.003 Å
• b: 16.815 ± 0.003 Å
• c: 19 ± 0.004 Å
• α: 101.087 ± 0.004°
• β: 108.835 ± 0.004°
• γ: 96.944 ± 0.004°
• Cell volume: 4254.2 ± 1.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No