Information card for entry 1575081

Structure parameters

• Formula: C36 H28 Cl2 Ir2 N8
• Calculated formula: C36 H28 Cl2 Ir2 N8
• Title of publication: Spectroscopic, structural and photophysical characterization of chloro-bridged iridium(III) and rhodium(III) dinuclear complexes with 1-phenyl-1<i>H</i>-pyrazole and their analogues with 1-(2,4-difluorophenyl)-1<i>H</i>-pyrazole.
• Authors of publication: Wójcik, Patryk; Latouche, Camille; Suwińska, Kinga; Kamecka, Anna
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 31
• Pages of publication: 12018 - 12029
• a: 10.2164 ± 0.0009 Å
• b: 11.4613 ± 0.001 Å
• c: 29.273 ± 0.003 Å
• α: 90°
• β: 90.266 ± 0.003°
• γ: 90°
• Cell volume: 3427.6 ± 0.6 ų
• Cell temperature: 297.15 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0321
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No