Information card for entry 4300382

Structure parameters

• Formula: C43 H38 Br Cu N4 P2 S
• Calculated formula: C43 H38 Br Cu N4 P2 S
• SMILES: [Cu](Br)([S]=C(N)NN=Cc1ncccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 14.45 ± 0.002 Å
• b: 12.884 ± 0.002 Å
• c: 23.616 ± 0.004 Å
• α: 90°
• β: 96.299 ± 0.004°
• γ: 90°
• Cell volume: 4370.1 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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