Information card for entry 4348758

Structure parameters

• Common name: Ni-muc-bpee
• Formula: C18 H18 N2 Ni O8.5
• Calculated formula: C18 H18 N2 Ni O8.5
• Title of publication: Construction of 3-Fold-Interpenetrated Three-Dimensional Metal-Organic Frameworks of Nickel(II) for Highly Efficient Capture and Conversion of Carbon Dioxide.
• Authors of publication: Ugale, Bharat; Dhankhar, Sandeep Singh; Nagaraja, C. M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 19
• Pages of publication: 9757 - 9766
• a: 37.06 ± 0.005 Å
• b: 13.328 ± 0.005 Å
• c: 9.373 ± 0.005 Å
• α: 90 ± 0.005°
• β: 102.153 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 4526 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.172
• Residual factor for significantly intense reflections: 0.0757
• Weighted residual factors for significantly intense reflections: 0.1939
• Weighted residual factors for all reflections included in the refinement: 0.2349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No