Information card for entry 7710333

Structure parameters

• Formula: C28 H36 Fe2 Mo N12 O17
• Calculated formula: C28 H36 Fe2 Mo N12 O17
• Title of publication: Magnetic interactions controlled by light in the family of Fe(II)-M(IV) (M = Mo, W, Nb) hybrid organic-inorganic frameworks
• Authors of publication: Magott, Michał; Ceglarska, Magdalena; Rams, Michał; Sieklucka, Barbara; Pinkowicz, Dawid
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 12.991 ± 0.0006 Å
• b: 20.3836 ± 0.0009 Å
• c: 15.7673 ± 0.0007 Å
• α: 90°
• β: 101.721 ± 0.002°
• γ: 90°
• Cell volume: 4088.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• 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: 0.0358
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0724
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No