Information card for entry 7110639

Structure parameters

• Common name: Cu3(H2L)(L).2H2O
• Formula: C36 H38 Cu3 N4 O10
• Calculated formula: C36 H38 Cu3 N4 O10
• Title of publication: An unusual [4 + 4 + 4] bishelical complex, Cu3(H2L)(L)·2H2O [H4L′ = N,N′-bis(3-hydroxysalicylidene)-1,4-diaminobutane]: synthesis and crystal structure
• Authors of publication: Sanmartín, Jesús; Bermejo, Manuel R.; García-Deibe, Ana M.; Piro, Oscar; Castellano, Eduardo E.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 19
• Pages of publication: 1953
• a: 17.098 ± 0.007 Å
• b: 13.871 ± 0.006 Å
• c: 15.366 ± 0.007 Å
• α: 90°
• β: 110.063 ± 0.0006°
• γ: 90°
• Cell volume: 3423 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2971
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.2272
• Goodness-of-fit parameter for all reflections included in the refinement: 0.915
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No