Information card for entry 2023352

Structure parameters

• Chemical name: Dibromidobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II)
• Formula: C18 H14 Br2 N2 O2 Zn
• Calculated formula: C18 H14 Br2 N2 O2 Zn
• Title of publication: Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide
• Authors of publication: Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W.
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2025
• Journal volume: 81
• Journal issue: 2
• a: 17.1095 ± 0.001 Å
• b: 7.202 ± 0.0006 Å
• c: 14.9534 ± 0.0011 Å
• α: 90°
• β: 96.472 ± 0.006°
• γ: 90°
• Cell volume: 1830.9 ± 0.2 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0604
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1407
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No