Information card for entry 7241454

Structure parameters

• Formula: C24 H38 Cu3 N14 O12
• Calculated formula: C24 H38 Cu3 N14 O12
• Title of publication: DNA intercalative trinuclear Cu(ii) complex with new trans axial nitrato ligation as an efficient catalyst for atmospheric CO2 fixation to epoxides
• Authors of publication: Dolai, Malay; Saha, Urmila; Biswas, Surajit; Chatterjee, Sabyasachi; Suresh Kumar, Gopinatha
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 9.779 ± 0.0004 Å
• b: 10.111 ± 0.0004 Å
• c: 18.6534 ± 0.0008 Å
• α: 90°
• β: 101.536 ± 0.002°
• γ: 90°
• Cell volume: 1807.11 ± 0.13 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No