Information card for entry 4333148

Structure parameters

• Formula: C16 H52 Co2 N12 Sb2 Se6
• Calculated formula: C16 H52 Co2 N12 Sb2 Se6
• SMILES: [Sb]([Se][Sb](=[Se])=[Se])(=[Se])(=[Se])=[Se].[Co]1234([NH](CC[NH2]1)CC[NH2]2)[NH](CC[NH2]3)CC[NH2]4.[Co]1234([NH](CC[NH2]1)CC[NH2]2)[NH](CC[NH2]3)CC[NH2]4
• Title of publication: Mixed-Valent Selenidoantimonates(III,V) with Transition-Metal Complexes as Counterions: Solvothermal Syntheses and Characterization of [M(dien)2]2Sb4Se9(M = Mn, Fe), [Co(dien)2]2Sb2Se6, and [Ni(dien)2]2Sb2Se5
• Authors of publication: Jia, Dingxian; Zhang, Yong; Zhao, Qianxin; Deng, Jie
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 24
• Pages of publication: 9812 - 9817
• a: 9.8063 ± 0.0012 Å
• b: 14.4563 ± 0.0018 Å
• c: 12.8319 ± 0.0012 Å
• α: 90°
• β: 90.585 ± 0.004°
• γ: 90°
• Cell volume: 1819 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No