Information card for entry 4300368

Structure parameters

• Formula: C61 H54 Cl2 Cu N4 O2
• Calculated formula: C61 H54 Cl2 Cu N4 O2
• SMILES: [Cu]123N4C(=O)C5=C(C4=C(C4=[N]1C(C1=C4CCCC1)=C(C1=[N]2C(C2=C1CCCC2)=C(C1N3C(=C2C=1CCCC2)C(=O)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)CCCC5.ClCCl
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• a: 12.989 ± 0.003 Å
• b: 14.384 ± 0.003 Å
• c: 14.553 ± 0.003 Å
• α: 86.078 ± 0.008°
• β: 82.261 ± 0.007°
• γ: 64.438 ± 0.009°
• Cell volume: 2430.4 ± 0.9 ų
• Cell temperature: 105 K
• Ambient diffraction temperature: 105 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No