Information card for entry 7236276

Structure parameters

• Formula: C13 H16 Mo4 N2 O13
• Calculated formula: C13 H16 Mo4 N2 O13
• Title of publication: Two new molybdates based on ∞[MonO3n+1]2− units (n = 11, 4) with proton conduction under ionothermal
• Authors of publication: Zhao, Y. H.; Jin, X. C.; Chen, L.; Ding, Y. F.; Mao, Z.; Fu, H.; Ao, Y. H.
• Journal of publication: RSC Advances
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 12
• Pages of publication: 7210
• a: 10.929 ± 0.002 Å
• b: 9.7226 ± 0.0019 Å
• c: 19.633 ± 0.004 Å
• α: 90°
• β: 101.82 ± 0.03°
• γ: 90°
• Cell volume: 2041.9 ± 0.7 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0276
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.0833
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No