Information card for entry 7248976

Structure parameters

• Chemical name: C16 H16 Cu N6 Ni O2, C2 O
• Formula: C18 H16 Cu N6 Ni O3
• Calculated formula: C18 H16 Cu N6 Ni O3
• Title of publication: Crystal engineering and sorption studies on CN- and dipyridyl-bridged 2D coordination polymers
• Authors of publication: Nguepmeni Eloundou, Valoise Brenda; Kenfack Tsobnang, Patrice; Kamgaing, Theophile; Gogoi, Chiranjib; Lopez-Salas, Nieves; Bourne, Susan A.
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 31
• Pages of publication: 4195 - 4204
• a: 5.9234 ± 0.0005 Å
• b: 9.5597 ± 0.0008 Å
• c: 10.2625 ± 0.0008 Å
• α: 114.847 ± 0.003°
• β: 96.831 ± 0.003°
• γ: 95.811 ± 0.003°
• Cell volume: 516.16 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No