Information card for entry 7711341

Structure parameters

• Formula: C17 H14 B N O3
• Calculated formula: C17 H14 B N O3
• Title of publication: Insertion chemistry of iron(ii) boryl complexes
• Authors of publication: Narro, Ana L.; Arman, Hadi D.; Tonzetich, Zachary J.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 11.4635 ± 0.0002 Å
• b: 16.0928 ± 0.0003 Å
• c: 7.756 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1430.83 ± 0.05 ų
• Cell temperature: 100.01 ± 0.14 K
• Ambient diffraction temperature: 100.01 ± 0.14 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 all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No