Information card for entry 7034251

Structure parameters

• Formula: C98 H144 Cl6 Er2 N16 O10
• Calculated formula: C98 H144 Cl6 Er2 N16 O10
• Title of publication: A lanthanide salen "square prism" and a wrapped exo-lanthanide salen "double decker".
• Authors of publication: Shu, Yu-Bo; Liu, Wei-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 14
• Pages of publication: 6353 - 6357
• a: 14.8845 ± 0.0009 Å
• b: 15.6342 ± 0.0008 Å
• c: 15.6534 ± 0.0011 Å
• α: 69.359 ± 0.005°
• β: 89.18 ± 0.005°
• γ: 61.857 ± 0.006°
• Cell volume: 2954.4 ± 0.4 ų
• Cell temperature: 80 ± 2 K
• Ambient diffraction temperature: 80 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1221
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.1888
• Weighted residual factors for all reflections included in the refinement: 0.2044
• Goodness-of-fit parameter for all reflections included in the refinement: 0.945
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No