Information card for entry 7719386

Structure parameters

• Formula: C26 H20 I4 N8 O2 Zn2
• Calculated formula: C26 H20 I4 N8 O2 Zn2
• Title of publication: Dual excitation-wavelength-dependent luminescence and proton transfer in ESIPT-active zinc(II) complexes with 2-(1<i>H</i>-pyrazol-1-yl)-4-(2-hydroxyphenyl)pyrimidine.
• Authors of publication: Shekhovtsov, Nikita A.; Vorobyeva, Sofia N.; Ryadun, Alexey A.; Nikolaenkova, Elena B.; Tikhonov, Alexey Y.; Bushuev, Mark B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 40
• Pages of publication: 15157 - 15168
• a: 7.8982 ± 0.0002 Å
• b: 8.3957 ± 0.0002 Å
• c: 13.0362 ± 0.0002 Å
• α: 96.528 ± 0.001°
• β: 90.982 ± 0.001°
• γ: 117.075 ± 0.001°
• Cell volume: 762.4 ± 0.03 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0348
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0518
• Weighted residual factors for all reflections included in the refinement: 0.0561
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No