Information card for entry 4313954

Structure parameters

• Formula: C51.33 H41.33 B0.67 N6.67 Yb0.67
• Calculated formula: C51.3333 H41.3333 B0.666667 N6.66667 Yb0.666667
• Title of publication: Facile Preparation and Photophysics of Near-Infrared Luminescent Lanthanide(III) Monoporphyrinate Complexes
• Authors of publication: Timothy J. Foley; Benjamin S. Harrison; Alison S. Knefely; Khalil A. Abboud; John R. Reynolds; Kirk S. Schanze; James M. Boncella
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5023 - 5032
• a: 11.9673 ± 0.0005 Å
• b: 14.007 ± 0.0006 Å
• c: 20.7721 ± 0.0008 Å
• α: 98.846 ± 0.002°
• β: 100.017 ± 0.002°
• γ: 106.862 ± 0.002°
• Cell volume: 3203.5 ± 0.2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.0718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No