Information card for entry 1573297

Structure parameters

• Formula: C92 H96 Cl20 P4 Pt2
• Calculated formula: C92 H96 Cl20 P4 Pt2
• Title of publication: Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization.
• Authors of publication: Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 16
• Journal issue: 1
• Pages of publication: 255 - 279
• a: 22.317 ± 0.003 Å
• b: 21.114 ± 0.002 Å
• c: 21.952 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10344 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0856
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1403
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No