Information card for entry 7028015

Structure parameters

• Formula: C12 H36 Cl2 O20 Zn
• Calculated formula: C12 H36 Cl2 O20 Zn
• Title of publication: Hydrogen bonded polymers and oligomers from metal salts and 18-crown-6
• Authors of publication: Steed, Jonathan W.; McCool, Brian J.; Junk, Peter C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 20
• Pages of publication: 3417
• a: 10.0638 ± 0.0004 Å
• b: 10.2361 ± 0.0003 Å
• c: 14.2184 ± 0.0006 Å
• α: 88.119 ± 0.002°
• β: 87.882 ± 0.002°
• γ: 60.87 ± 0.002°
• Cell volume: 1278.38 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No