Information card for entry 7029844

Structure parameters

• Common name: COE-3
• Formula: C15.19 O76 Si37.59
• Calculated formula: C15.52 O76 Si37.76
• Title of publication: Ab initio structure determination of interlayer expanded zeolites by single crystal rotation electron diffraction.
• Authors of publication: Guo, Peng; Liu, Leifeng; Yun, Yifeng; Su, Jie; Wan, Wei; Gies, Hermann; Zhang, Haiyan; Xiao, Feng-Shou; Zou, Xiaodong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 27
• Pages of publication: 10593 - 10601
• a: 7.19 ± 0.1 Å
• b: 21.79 ± 0.1 Å
• c: 13.62 ± 0.1 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2134 ± 3 ų
• Number of distinct elements: 3
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.4496
• Residual factor for significantly intense reflections: 0.3754
• Weighted residual factors for significantly intense reflections: 0.7646
• Weighted residual factors for all reflections included in the refinement: 0.7956
• Goodness-of-fit parameter for all reflections included in the refinement: 4.147
• Diffraction radiation wavelength: 0.0251 Å
• Diffraction radiation type: Electrons
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No