Information card for entry 7249786

Structure parameters

• Chemical name: 1-hydroxy-2-(naphthalen-1-yl)-1H-imidazole 3-oxide
• Formula: C13 H10 N2 O2
• Calculated formula: C13 H10 N2 O2
• Title of publication: Scalable ultrasound-assisted synthesis of hydroxy imidazole N-oxides and evaluation of their anti-proliferative activities; mechanistic insights into the deoximation of dioximes
• Authors of publication: Mukhia, Munna; Rai, Sagar; Rai, Yachna; Chakraborty, Koushik; Dey, Sangita; Tiwary, Bipransh Kumar; Brahman, Dhiraj; Kumar, Anoop; Pradhan, Kiran
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 2
• Pages of publication: 938 - 946
• a: 8.9333 ± 0.0005 Å
• b: 10.9751 ± 0.0006 Å
• c: 11.0707 ± 0.0006 Å
• α: 90°
• β: 90.371 ± 0.002°
• γ: 90°
• Cell volume: 1085.39 ± 0.1 ų
• Cell temperature: 304 ± 2 K
• Ambient diffraction temperature: 304 ± 2 K
• Number of distinct elements: 4
• 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: 0.0412
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No