Information card for entry 7200745

Structure parameters

• Formula: C8 H7 Cl2 Li O5
• Calculated formula: C8 H7 Cl2 Li O5
• Title of publication: π-Stacking of quinoid rings in crystals of alkali diaqua hydrogen chloranilates
• Authors of publication: Molčanov, Krešimir; Kojić-Prodić, Biserka; Meden, Anton
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 7
• Pages of publication: 1407
• a: 13.72 ± 0.02 Å
• b: 4.975 ± 0.002 Å
• c: 14.7 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1003.4 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for all reflections included in the refinement: 0.1336
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No