Information card for entry 1576805

Structure parameters

• Formula: C97.5 H234 N48 O86 Pd6
• Calculated formula: C97.5 H165 N48 O51.5 Pd6
• Title of publication: Selective photocatalytic oxidative cleavage of terminal alkynes to carboxylic acids within a water-soluble Pd₆ nanocage.
• Authors of publication: Maitra, Pranay Kumar; Rinshad, Valiyakath Abdul; Hickey, Neal; Mukherjee, Partha Sarathi
• Journal of publication: Chemical science
• Year of publication: 2026
• Journal volume: 17
• Journal issue: 9
• Pages of publication: 4487 - 4495
• a: 21.189 ± 0.004 Å
• b: 22.633 ± 0.003 Å
• c: 23.227 ± 0.004 Å
• α: 62.872 ± 0.01°
• β: 77.08 ± 0.03°
• γ: 69.898 ± 0.014°
• Cell volume: 9280 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1573
• Residual factor for significantly intense reflections: 0.0682
• Weighted residual factors for significantly intense reflections: 0.1584
• Weighted residual factors for all reflections included in the refinement: 0.185
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No