Information card for entry 2005120

Structure parameters

• Formula: C30 H40 Cu N4 O9
• Calculated formula: C26 H36 Cu N4 O13
• Title of publication: Bis[2-(2-pyridylmethylaminomethyl)phenol]copper(II) Diacetate Trihydrate [Cu(HBPA)~2~](CH~3~COO)~2~.3H~2~O
• Authors of publication: Neves, A.; Vencato, I.; Verani, C. N.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 7
• Pages of publication: 1648 - 1651
• a: 11.356 ± 0.001 Å
• b: 11.862 ± 0.001 Å
• c: 12.989 ± 0.001 Å
• α: 106.88 ± 0.01°
• β: 102.95 ± 0.01°
• γ: 94.38 ± 0.01°
• Cell volume: 1612.8 ± 0.3 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.08
• Residual factor for significantly intense reflections: 0.0609
• Weighted residual factors for significantly intense reflections: 0.0823
• Goodness-of-fit parameter for significantly intense reflections: 1.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No