Information card for entry 4300377

Structure parameters

• Formula: C44 H39 Cu I N3 P2 S
• Calculated formula: C44 H39 Cu I N3 P2 S
• SMILES: [Cu](I)([S]=C(N)NN=Cc1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 9.5127 ± 0.0011 Å
• b: 24.6398 ± 0.0018 Å
• c: 17.5613 ± 0.0013 Å
• α: 90°
• β: 95.477 ± 0.002°
• γ: 90°
• Cell volume: 4097.4 ± 0.6 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/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No