Information card for entry 7027487

Structure parameters

• Formula: C100 H82.5 N8 O3.25 Yb2
• Calculated formula: C100 H82.5 N8 O3.25 Yb2
• Title of publication: Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes
• Authors of publication: Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 3053
• a: 16.758 ± 0.001 Å
• b: 27.758 ± 0.001 Å
• c: 20.303 ± 0.001 Å
• α: 90°
• β: 108.09 ± 0.01°
• γ: 90°
• Cell volume: 8977.5 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0999
• Residual factor for significantly intense reflections: 0.0888
• Weighted residual factors for significantly intense reflections: 0.1809
• Weighted residual factors for all reflections included in the refinement: 0.1872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.235
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No