Information card for entry 8104623

Structure parameters

• Formula: C34 H36 Cl4 F6 N10 O12
• Calculated formula: C34 H36 Cl4 F6 N10 O12
• Title of publication: Crystal structure of bis(2-((E)-5-chloro-2-hydroxybenzylidene)hydrazineyl)methaniminium trifluoroacetate dihydrate, C34H36Cl4N10O12
• Authors of publication: Jin, Ze-Sen; Liu, Xiao-jing; Liu, E.; Liang, Tongling; Jian, Fangfang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 5
• Pages of publication: 919 - 922
• a: 10.3071 ± 0.0003 Å
• b: 13.4696 ± 0.0004 Å
• c: 16.1893 ± 0.0004 Å
• α: 81.467 ± 0.002°
• β: 77.726 ± 0.002°
• γ: 82.055 ± 0.002°
• Cell volume: 2158.64 ± 0.11 ų
• Cell temperature: 169.99 ± 0.11 K
• Ambient diffraction temperature: 169.99 ± 0.11 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0612
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1544
• Weighted residual factors for all reflections included in the refinement: 0.1609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No