Information card for entry 7248975

Structure parameters

• Formula: C8 H10 N3 Ni O2
• Calculated formula: C7.99 H10 N2.99 Ni O2
• 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: 6.3253 ± 0.0013 Å
• b: 9.2032 ± 0.0018 Å
• c: 10.202 ± 0.002 Å
• α: 64.48 ± 0.03°
• β: 74.18 ± 0.03°
• γ: 78.74 ± 0.03°
• Cell volume: 513.6 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0615
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0848
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No