Information card for entry 4062950

Structure parameters

• Formula: C48 H32 N2 O4
• Calculated formula: C48 H32 N2 O4
• SMILES: C(=N\c1c(cccc1c1cc2c(o1)cccc2)c1cc2c(cccc2)o1)(C)/C(=N/c1c(cccc1c1cc2c(cccc2)o1)c1cc2c(cccc2)o1)/C
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 10.1345 ± 0.0006 Å
• b: 17.4948 ± 0.0004 Å
• c: 19.2433 ± 0.0006 Å
• α: 90 ± 0.001°
• β: 90 ± 0.001°
• γ: 90 ± 0.001°
• Cell volume: 3411.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No