Information card for entry 2225693

Structure parameters

• Chemical name: (μ-1,4,7,10-Tetraoxacyclododecane)bis[(1,4,7,10-tetraoxacyclododecane)lithium] bis(perchlorate)
• Formula: C24 H48 Cl2 Li2 O20
• Calculated formula: C24 H48 Cl2 Li2 O20
• SMILES: [Li]123([O]4CC[O]1CC[O]2CC[O]3CC4)[O]1CCOCC[O](CCOCC1)[Li]123[O]4CC[O]1CC[O]2CC[O]3CC4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: (μ-1,4,7,10-Tetraoxacyclododecane)bis[(1,4,7,10-tetraoxacyclododecane)lithium] bis(perchlorate)
• Authors of publication: Guzei, Ilia A.; Spencer, Lara C.; Xiao, Lingyun; Burnette, Ronald R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: m438 - m439
• a: 7.7395 ± 0.0007 Å
• b: 14.1924 ± 0.0013 Å
• c: 15.2801 ± 0.0014 Å
• α: 90°
• β: 95.962 ± 0.002°
• γ: 90°
• Cell volume: 1669.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0366
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.0923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes