Information card for entry 7018289

Structure parameters

• Common name: tetrakis(miu3-4-pyridinoxo)-tetrakis(methanol)-tetra-lithium
• Chemical name: tetrakis(miu3-4-pyridinoxo)- tetrakis(methanol)-tetra-lithium
• Formula: C24 H32 Li4 N4 O8
• Calculated formula: C24 H32 Li4 N4 O8
• SMILES: [Li]12([O]3([Li]4([O]1(c1ccncc1)[Li]1([O]4([Li]3([O]21c1ccncc1)[OH]C)c1ccncc1)[OH]C)[OH]C)c1ccncc1)[OH]C
• Title of publication: Lithium cubane clusters as tetrahedral, square planar, and linear nodes for supramolecular assemblies.
• Authors of publication: Zhao, Xiang; Wu, Tao; Bu, Xianhui; Feng, Pingyun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 14
• Pages of publication: 3902 - 3905
• a: 17.7886 ± 0.0004 Å
• b: 8.5114 ± 0.0002 Å
• c: 19.2578 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2915.74 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for all reflections: 0.0997
• Residual factor for significantly intense reflections: 0.0769
• Weighted residual factors for significantly intense reflections: 0.2207
• Weighted residual factors for all reflections included in the refinement: 0.2448
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No