Information card for entry 4515894

Structure parameters

• Formula: C99 H56 Cl2 Co15 O38 P3 Pd9
• Calculated formula: C99 H56 Cl2 Co15 O38 P3 Pd9
• Title of publication: Cluster Core Isomerism Induced by Crystal Packing Effects in the [HCo₁₅Pd₉C₃(CO)₃₈]^2- Molecular Nanocluster.
• Authors of publication: Berti, Beatrice; Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano
• Journal of publication: ACS omega
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 10
• Pages of publication: 13239 - 13250
• a: 12.7433 ± 0.0012 Å
• b: 16.7009 ± 0.0016 Å
• c: 28.227 ± 0.003 Å
• α: 90.39 ± 0.002°
• β: 94.828 ± 0.002°
• γ: 112.141 ± 0.002°
• Cell volume: 5539.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.0686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No