Information card for entry 4311749

Structure parameters

• Formula: C5 H16 Mo3 N2 O14 S
• Calculated formula: C5 Mo3 N2 O14 S
• Title of publication: [C~5~N~2~H~14~][(MoO~3~)~3~(SO~4~)].H~2~O: Sulfated a-Molybdena Chains
• Authors of publication: Jesse R. Gutnick; Eric A. Muller; Amy Narducci Sarjeant; Alexander J. Norquist
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 6528 - 6530
• a: 8.5388 ± 0.0006 Å
• b: 10.7467 ± 0.0007 Å
• c: 18.1127 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1662.09 ± 0.19 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0499
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for all reflections: 0.0779
• Weighted residual factors for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 0.889
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No