Information card for entry 7707370

Structure parameters

• Formula: H44 Mn3 O38 P4 Ru2
• Calculated formula: H44 Mn3 O38 P4 Ru2
• Title of publication: Interlayer hydrogen bonding directed magnetic properties for a different number of water-intercalated structural heterometallic phosphates based on paddlewheel units Ru₂(PO₄)₄⁶.
• Authors of publication: Xue, Xiang-Xian; Ding, Tuo; Zhang, Pei; Yang, Jian-Hui; Liu, Bin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 24
• Pages of publication: 8364 - 8371
• a: 16.1522 ± 0.0018 Å
• b: 9.8495 ± 0.0011 Å
• c: 19.642 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3124.9 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0476
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No