Information card for entry 4300454

Structure parameters

• Formula: C33 H57 Cl7 Cu N7 O5
• Calculated formula: C33 H55 Cl7 Cu N7 O5
• SMILES: [Cu]12([n]3[n](C([n]4[n]1c(C(C)C)cc4C(C)C)[n]1[n]2c(C(C)C)cc1C(C)C)c(cc3C(C)C)C(C)C)[N]#CC.Cl(=O)(=O)(=O)[O-].ClCCl.ClCCl.ClCCl.O
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 13.589 ± 0.006 Å
• b: 21.247 ± 0.01 Å
• c: 16.155 ± 0.008 Å
• α: 90°
• β: 93.546 ± 0.006°
• γ: 90°
• Cell volume: 4655.1 ± 3.8 ų
• Cell temperature: 203.1 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