Information card for entry 7701800

Structure parameters

• Chemical name: Cu2KClN2O12Si4C48H108
• Formula: C48 H108 Cl Cu2 K N2 O12 Si4
• Calculated formula: C48 H108 Cl Cu2 K N2 O12 Si4
• Title of publication: Synthesis of Homoleptic, Divalent Lanthanide (Sm, Eu) Complexes via Oxidative Transmetallation
• Authors of publication: Gompa, Thaige P.; Jiang, Ningxin; Bacsa, John; La Pierre, Henry Storms
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 20.524 ± 0.008 Å
• b: 19.826 ± 0.009 Å
• c: 19.692 ± 0.008 Å
• α: 90°
• β: 112.541 ± 0.015°
• γ: 90°
• Cell volume: 7401 ± 5 ų
• Cell temperature: 190 K
• Ambient diffraction temperature: 191.07 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1125
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.128
• Weighted residual factors for all reflections included in the refinement: 0.1719
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No