Information card for entry 7034900

Structure parameters

• Chemical name: LiTCS
• Formula: C40 H44 Li4 N2 O11 Si
• Calculated formula: C40 H44 Li4 N2 O11 Si
• Title of publication: Thermal conversion of a tailored metal-organic framework into lithium silicate with an unusual morphology for efficient CO2 capture.
• Authors of publication: Lee, Jae Hwa; Moon, Byoungnam; Kim, Tae Kyung; Jeoung, Sungeun; Moon, Hoi Ri
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 34
• Pages of publication: 15130 - 15134
• a: 13.725 ± 0.003 Å
• b: 14.074 ± 0.003 Å
• c: 14.187 ± 0.003 Å
• α: 114.15 ± 0.03°
• β: 114.2 ± 0.03°
• γ: 98.24 ± 0.03°
• Cell volume: 2115.6 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0663
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1731
• Weighted residual factors for all reflections included in the refinement: 0.1816
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.64999 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No