Information card for entry 4322524

Structure parameters

• Formula: C55.2 H52.8 B2 Gd2 N24.4 O14.4
• Calculated formula: C55.2 H52.8 B2 Gd2 N24.4 O14.4
• Title of publication: Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates
• Authors of publication: Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 5769 - 5776
• a: 16.622 ± 0.006 Å
• b: 16.622 ± 0.004 Å
• c: 24.19 ± 0.05 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6683 ± 14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.1883
• Residual factor for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections: 0.2559
• Weighted residual factors for significantly intense reflections: 0.2016
• Goodness-of-fit parameter for all reflections: 1.139
• Goodness-of-fit parameter for significantly intense reflections: 1.363
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No