Information card for entry 1550731

Structure parameters

• Formula: C56 H115 K3 N8 O18 Rh Sn10
• Calculated formula: C56 H116 K3 N8 O18 Rh Sn10
• SMILES: [Sn]12[Sn]34[Sn]56[Sn]78[Sn]9%10[Sn]%111[Sn]13[Sn]35[Sn]57[Sn]9[Rh]2468%10%11135.[K]1234567[O]8CC[N]19CC[O]2CC[O]3CC[N]4(CC[O]5CC[O]6CC9)CC[O]7CC8.[K]1234567[O]8CC[N]19CC[O]2CC[O]3CC[N]4(CC[O]5CC[O]6CC9)CC[O]7CC8.[K]1234567[O]8CC[N]19CC[O]2CC[O]3CC[N]4(CC[O]5CC[O]6CC9)CC[O]7CC8.NCCN
• Title of publication: Synthesis and Structure of a Family of Rhodium Polystannide Clusters [Rh@Sn10]3‒, [Rh@Sn12]3‒, [Rh2@Sn17]6‒ and the First Triply-Fused Stannide, [Rh3@Sn24]5‒
• Authors of publication: Liu, Chao; Jin, Xiao; Li, Leijiao; Xu, Jun; McGrady, John E.; Sun, Zhong-Ming
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 15.142 ± 0.003 Å
• b: 15.879 ± 0.004 Å
• c: 19.18 ± 0.005 Å
• α: 81.348 ± 0.005°
• β: 87.147 ± 0.004°
• γ: 74.041 ± 0.005°
• Cell volume: 4383.3 ± 1.8 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1032
• Residual factor for significantly intense reflections: 0.0707
• Weighted residual factors for significantly intense reflections: 0.1831
• Weighted residual factors for all reflections included in the refinement: 0.2052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No