Information card for entry 2242818

Structure parameters

• Chemical name: Poly[[di-μ~3~-glycine-lithium] perchlorate]
• Formula: C4 H10 Cl Li N2 O8
• Calculated formula: C4 H10 Cl Li N2 O8
• SMILES: [O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Li]1(OC(=O)C[NH3+])[O](C(=O)C[NH3+])[Li]2(OC(=O)C[NH3+])[O](C(=[O]1)C[NH3+])[Li]1(OC(=O)C[NH3+])[O](C(=[O]2)C[NH3+])[Li](OC(=[O]1)C[NH3+])OC(=O)C[NH3+]
• Title of publication: Crystal structure and Hirshfeld surface analysis of poly[[di-μ~3~-glycine-lithium] perchlorate]
• Authors of publication: Revathi, Palanisamy; Mohan, Janani S.; Balakrishnan, Thangavelu; Ramamurthi, Kandasamy; Thamotharan, Subbiah
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 2
• Pages of publication: 134 - 138
• a: 12.7792 ± 0.0014 Å
• b: 5.2144 ± 0.0004 Å
• c: 15.6368 ± 0.0018 Å
• α: 90°
• β: 111.808 ± 0.004°
• γ: 90°
• Cell volume: 967.4 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0371
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0881
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes