Information card for entry 4020313

Structure parameters

• Formula: C21 H26 Cl Cu N2
• Calculated formula: C21 H26 Cl Cu N2
• SMILES: [Cu](Cl)=C1N(c2c(cc(cc2C)C)C)CCN1c1c(cc(cc1C)C)C
• Authors of publication: Silvia Díez-González; Harneet Kaur; Fabiano Kauer Zinn; Edwin D. Stevens; Steven P. Nolan
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 4784 - 4796
• a: 8.784 ± 0.0007 Å
• b: 15.4247 ± 0.0012 Å
• c: 30.289 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4103.9 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No