Information card for entry 7029846

Structure parameters

• Common name: COE-3
• Mineral name: ?hkl_Phase?
• Formula: C19.12 O76 Si39.34
• Calculated formula: C19.1288 O76 Si39.3384
• 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: 7.40027 ± 0.00035 Å
• b: 23.4265 ± 0.0017 Å
• c: 14.00808 ± 0.00066 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2428.5 ± 0.2 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• 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 R(I) for significantly intense reflections: 0.016
• Goodness-of-fit parameter for all reflections: 2.5
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5406 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No