Information card for entry 4100461

Structure parameters

• Formula: C40 H34 Cl8 N4 O5
• Calculated formula: C40 H34 Cl8 N4 O5
• SMILES: ClC(Cl)(Cl)Cl.ClC(Cl)(Cl)Cl.O=C(N(C)c1ccc(cc1)C(=O)N(C)c1ccc(cc1)C(=O)N(C)c1ccc(cc1)C(=O)Oc1ccccc1)c1ccc(NC)cc1
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 14.883 ± 0.006 Å
• b: 13.509 ± 0.004 Å
• c: 20.809 ± 0.009 Å
• α: 90°
• β: 92.07 ± 0.04°
• γ: 90°
• Cell volume: 4180 ± 2 ų
• Cell temperature: 93.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No