Information card for entry 4317909

Structure parameters

• Formula: C19 H21 I3 N9 U
• Calculated formula: C18 H16.5 I3 N8.5 U
• Title of publication: Structural and Density Functional Studies of Uranium(III) and Lanthanum(III) Complexes with a Neutral Tripodal N-Donor Ligand Suggesting the Presence of a U-N Back-Bonding Interaction
• Authors of publication: Marinella Mazzanti; Raphaël Wietzke; Jacques Pécaut; Jean-Marc Latour; Pascale Maldivi; Michael Remy
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2389 - 2399
• a: 9.95 ± 0.002 Å
• b: 12.19 ± 0.002 Å
• c: 14.44 ± 0.003 Å
• α: 111.41 ± 0.03°
• β: 92.07 ± 0.03°
• γ: 109.17 ± 0.03°
• Cell volume: 1515.7 ± 0.7 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 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: 0.0743
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No