Information card for entry 2010955

Structure parameters

• Formula: C22 H24 Cu2 N4 O8
• Calculated formula: C22 H24 Cu2 N4 O8
• SMILES: c1ccc2c([n]1[Cu]1345[O]=C(C)O[Cu]5([n]5cccc6cc[nH]c56)([O]=C(C)O1)(OC(C)=[O]4)[O]=C(C)O3)[nH]cc2
• Title of publication: Tetra-μ-acetato-<i>O</i>:<i>O</i>'-bis[(7-azaindole-<i>N</i>)copper(II)]
• Authors of publication: Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 5
• Pages of publication: e193 - e193
• a: 7.453 ± 0.005 Å
• b: 14.911 ± 0.005 Å
• c: 11.458 ± 0.005 Å
• α: 90°
• β: 107.75 ± 0.04°
• γ: 90°
• Cell volume: 1212.7 ± 1.1 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes