Information card for entry 4312791

Structure parameters

• Formula: C24 H56 O8 P4 Se8 Zn2
• Calculated formula: C24 H56 O8 P4 Se8 Zn2
• SMILES: C(C)(C)OP1(OC(C)C)=[Se][Zn]2([Se]1)[Se]P(OC(C)C)(OC(C)C)=[Se][Zn]1([Se]P(OC(C)C)(OC(C)C)=[Se]1)[Se]=P(OC(C)C)(OC(C)C)[Se]2
• Title of publication: Syntheses, Solid-State Structures, and Solution Studies by VT 31P NMR of [Zn{Se2P(OEt)2}2]∞and [Zn2{Se2P(OiPr)2}4]
• Authors of publication: Bidyut Kumar Santra; Ben-Jie Liaw; Chiu-Mine Hung; C. W. Liu; Ju-Chun Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 8866 - 8871
• a: 11.239 ± 0.008 Å
• b: 17.396 ± 0.013 Å
• c: 25.915 ± 0.013 Å
• α: 90°
• β: 99.46 ± 0.05°
• γ: 90°
• Cell volume: 4998 ± 6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1477
• Residual factor for significantly intense reflections: 0.0669
• Weighted residual factors for significantly intense reflections: 0.1431
• Weighted residual factors for all reflections included in the refinement: 0.1731
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No