Information card for entry 4300383

Structure parameters

• Formula: C45 H41 Cl Cu N5 P2 S
• Calculated formula: C45 H41 Cl Cu N5 P2 S
• SMILES: [Cu](Cl)([S]=C(N)NN=Cc1ncccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.N#CC
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 28.879 ± 0.004 Å
• b: 12.6148 ± 0.0015 Å
• c: 22.867 ± 0.003 Å
• α: 90°
• β: 96.526 ± 0.002°
• γ: 90°
• Cell volume: 8276.5 ± 1.8 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 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