Information card for entry 7058350

Structure parameters

• Formula: C21 H20 Fe N4 O
• Calculated formula: C21 H20 Fe N4 O
• Title of publication: Synthesis, characterization and antimicrobial evaluation of ferrocene‒oxime ether benzyl 1H-1,2,3-triazole hybrids
• Authors of publication: Swetha, Yagnam; Reddy, Eda Rami; Kumar, Jakku Ranjith; Trivedi, Rajiv; Giribabu, Lingamallu; Sridhar, Balasubramanian; Rathod, Balaji; Prakasham, Reddy Shetty
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 21
• Pages of publication: 8341
• a: 18.8546 ± 0.0002 Å
• b: 9.6665 ± 0.0001 Å
• c: 10.3076 ± 0.0003 Å
• α: 90°
• β: 93.9343 ± 0.0006°
• γ: 90°
• Cell volume: 1874.22 ± 0.06 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 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: 0.0741
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No