Information card for entry 7232915

Structure parameters

• Formula: C14 H40 Mo0.5 N8 Ni O8
• Calculated formula: C14 H24 Mo0.5 N8 Ni O8
• Title of publication: A two-fold 3D interpenetrating cyanido-bridged network based on the octa-coordinated [Mo(CN)8]4- building block
• Authors of publication: Heczko, Michał; Sumińska, Ewa; Sieklucka, Barbara; Nowicka, Beata
• Journal of publication: CrystEngComm
• Year of publication: 2019
• a: 18.9128 ± 0.0006 Å
• b: 18.9128 ± 0.0006 Å
• c: 15.2392 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5451 ± 0.3 ų
• Cell temperature: 117 ± 2 K
• Ambient diffraction temperature: 117 ± 2 K
• Number of distinct elements: 6
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.0908
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No