Information card for entry 7046413

Structure parameters

• Chemical name: Mn2Nbformate
• Formula: C18 H2 Mn4 N18 Nb2 O14
• Calculated formula: C18 H2 Mn4 N18 Nb2 O14
• Title of publication: Cross-linking of cyanide magnetic coordination polymers by rational insertion of formate, cyanide or azide.
• Authors of publication: Handzlik, Gabriela; Sieklucka, Barbara; Pinkowicz, Dawid
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 34
• Pages of publication: 11888 - 11894
• a: 12.0732 ± 0.0001 Å
• b: 12.0732 ± 0.0001 Å
• c: 13.4352 ± 0.0003 Å
• α: 90 ± 0.003°
• β: 90 ± 0.003°
• γ: 90 ± 0.003°
• Cell volume: 1958.34 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 108
• Hermann-Mauguin space group symbol: I 4 c m
• Hall space group symbol: I 4 -2c
• Residual factor for all reflections: 0.0339
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No