Information card for entry 7720503

Structure parameters

• Formula: C40 H60 Ir4 Nb
• Calculated formula: C40 H60 Ir4 Nb
• Title of publication: Visible-light driven H₂ reductive elimination unlocks reactivity in polyhydrido niobium iridium clusters.
• Authors of publication: Dubrawski, Zachary; Aïssiou, Samy; Jeanneau, Erwann; Thieuleux, Chloé; Camp, Clément
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 620 - 629
• a: 12.7793 ± 0.0002 Å
• b: 24.674 ± 0.0003 Å
• c: 13.8521 ± 0.0002 Å
• α: 90°
• β: 101.491 ± 0.001°
• γ: 90°
• Cell volume: 4280.25 ± 0.11 ų
• Cell temperature: 100.02 ± 0.12 K
• Ambient diffraction temperature: 100.02 ± 0.12 K
• Number of distinct elements: 4
• 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: 0.0639
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1495
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No