Information card for entry 7703042

Structure parameters

• Formula: C48 H94 Ag2 Br2 Mo8 N6 O28
• Calculated formula: C48 H94 Ag2 Br2 Mo8 N6 O28
• Title of publication: [{AgL}₂Mo₈O₂₆]^n- complexes: a combined experimental and theoretical study.
• Authors of publication: Chupina, Anastasia V.; Shayapov, Vladimir; Novikov, Alexander S.; Volchek, Victoria V.; Benassi, Enrico; Abramov, Pavel A.; Sokolov, Maxim N.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 1522 - 1530
• a: 13.8102 ± 0.0016 Å
• b: 19.359 ± 0.0007 Å
• c: 15.2005 ± 0.0011 Å
• α: 90°
• β: 116.826 ± 0.012°
• γ: 90°
• Cell volume: 3626.5 ± 0.6 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 7
• 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: 0.0789
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No