Information card for entry 7133905

Structure parameters

• Formula: C102 H115 N9 Ni4 O8 S8
• Calculated formula: C102 H115 N9 Ni4 O8 S8
• Title of publication: Diamidocarbene-derived palladium and nickel-sulfur clusters.
• Authors of publication: Lee, Minji; Noh, Hyunju; Kim, Youngsuk
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• a: 15.1288 ± 0.0008 Å
• b: 15.5209 ± 0.0008 Å
• c: 21.5815 ± 0.0012 Å
• α: 89.171 ± 0.002°
• β: 84.225 ± 0.002°
• γ: 76.607 ± 0.002°
• Cell volume: 4904.6 ± 0.5 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: 0.0517
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No