Information card for entry 7030293

Structure parameters

• Common name: zincarsenide
• Formula: C40 H80 As14 Cs2 K2 N8 O12 Zn
• Calculated formula: C40 H80 As14 Cs2 K2 N8 O12 Zn
• Title of publication: Synthesis, structure and band gap energy of covalently linked cluster-assembled materials.
• Authors of publication: Mandal, Sukhendu; Reber, Arthur C.; Qian, Meichun; Liu, Ran; Saavedra, Hector M.; Sen, Saikat; Weiss, Paul S.; Khanna, Shiv N.; Sen, Ayusman
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 40
• Pages of publication: 12365 - 12377
• a: 14.839 ± 0.003 Å
• b: 20.741 ± 0.005 Å
• c: 24.297 ± 0.005 Å
• α: 90°
• β: 95.691 ± 0.004°
• γ: 90°
• Cell volume: 7441 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.1177
• 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