Information card for entry 7208393

Structure parameters

• Formula: C48 H142 Cl2 N30 O4 S14 Sb4 Y6
• Calculated formula: C48 H138 Cl2 N30 O4 S14 Sb4 Y6
• SMILES: C1C[NH]2CC[NH]3CC[NH]4CC[NH2][Y]56234([NH2]1)O[Y]12347([NH2]CC[NH]1CC[NH]2CC[NH]3CC[NH2]7)[S]5[Sb](S6)S4.S([Y]12345([NH2]CC[NH]1CC[NH]2CC[NH]3CC[NH2]4)O[Y]1234(O5)(S[Sb](=S)([S-])[S-])[NH2]CC[NH]1CC[NH]2CC[NH]3CC[NH2]4)[Sb](=S)([S-])[S-].[Cl-].C1C[NH]2CC[NH]3CC[NH]4CC[NH2][Y]56234([NH2]1)O[Y]12347([NH2]CC[NH]1CC[NH]2CC[NH]3CC[NH2]7)[S]5[Sb](S6)S4.[Cl-]
• Title of publication: A series of new lanthanoid thioantimonates: a rare example of organic-decorated cationic lanthanoid thioantimonate chains based on asymmetric dinuclear lanthanide complexes
• Authors of publication: Zhou, Jian; An, Litao; Hu, Feilong; Liu, Xing; Zhao, Rongqing; Lin, Jianwu
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 17
• Pages of publication: 5544
• a: 15.543 ± 0.003 Å
• b: 15.647 ± 0.003 Å
• c: 41.256 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10034 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• 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: 0.0962
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No