Information card for entry 7249799

Structure parameters

• Formula: C14 H12 Cl2 N2 O
• Calculated formula: C14 H12 Cl2 N2 O
• Title of publication: Unraveling the structure–property relationships in fluorescent phenylhydrazones: the role of substituents and molecular interactions
• Authors of publication: Sobczak, Paulina; Sierański, Tomasz; Świątkowski, Marcin; Trzęsowska-Kruszyńska, Agata; Kolińska, Jolanta
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 3
• Pages of publication: 1514 - 1526
• a: 4.6156 ± 0.0001 Å
• b: 9.4927 ± 0.0001 Å
• c: 30.124 ± 0.0004 Å
• α: 90°
• β: 93.547 ± 0.001°
• γ: 90°
• Cell volume: 1317.34 ± 0.04 ų
• Cell temperature: 99.9 ± 0.5 K
• Ambient diffraction temperature: 99.9 ± 0.5 K
• Number of distinct elements: 5
• 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: 0.0249
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No