Information card for entry 4300595

Structure parameters

• Formula: C58 H52 Cu2 O2 P2 S4
• Calculated formula: C58 H52 Cu2 O2 P2 S4
• SMILES: C1(=[S]2[Cu]3([P](c4ccccc4)(c4ccccc4)c4ccccc4)(OC(=C1)c1ccc(cc1)C)[S]1=C(C=C(c4ccc(cc4)C)O[Cu]231[P](c1ccccc1)(c1ccccc1)c1ccccc1)SC)SC
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 12.678 ± 0.003 Å
• b: 18.57 ± 0.005 Å
• c: 11.059 ± 0.004 Å
• α: 90°
• β: 98.54 ± 0.02°
• γ: 90°
• Cell volume: 2575 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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