Information card for entry 2312585

Structure parameters

• Chemical name: Bis[aquabis(2,2'-biimidazole-κ^2^<i>N</i>,<i>N</i>')copper(II)] bis(malonato-κ^2^<i>O</i>,<i>O</i>')bis(perchlorato-κ<i>O</i>)copper(II) 2.2-hydrate
• Formula: C30 H32.4 Cl2 Cu3 N16 O20.2
• Calculated formula: C30 H32 Cl2 Cu3 N16 O20
• Title of publication: Multivalent hydrogen-bonded architectures directed by self-complementarity between [Cu(2,2'-biimidazole)] and malonate building blocks.
• Authors of publication: Atencio, Reinaldo; Linares, Marciel M.; González, Teresa; Briceño, Alexander
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 9
• a: 17.9569 ± 0.0011 Å
• b: 15.2466 ± 0.0006 Å
• c: 16.6781 ± 0.001 Å
• α: 90°
• β: 95.296 ± 0.005°
• γ: 90°
• Cell volume: 4546.7 ± 0.4 ų
• Cell temperature: 298 ± 0.3 K
• Ambient diffraction temperature: 298 ± 0.3 K
• Number of distinct elements: 6
• 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: 0.1057
• Residual factor for significantly intense reflections: 0.0699
• Weighted residual factors for significantly intense reflections: 0.177
• Weighted residual factors for all reflections included in the refinement: 0.2043
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes