Information card for entry 7025574

Structure parameters

• Common name: Bis(bis(3-phenyl-1H-pyrazolyl)(5-phenyl-1H-pyrazolyl)borate- eta$3!-kappaN$2'!,N$2''!,N$2'''!)bis(mu-(2,6-(1- methylethyl)phenyl)phosphinidene)di(tetrahydrofuran)dineodymium(iii), tetrahydrofuran adduct
• Chemical name: Bis[bis(3-phenyl-1<i>H</i>-pyrazolyl)(5-phenyl-1<i>H</i>-pyrazolyl)borate- η^3^-κ<i>N</i>^2'^,<i>N</i>^2''^,<i>N</i>^2'''^]bis{μ-[2,6- (1-methylethyl)phenyl]phosphinidene}di(tetrahydrofuran)dineodymium(III), tetrahydrofuran adduct
• Formula: C90 H102 B2 N12 Nd2 O3 P2
• Calculated formula: C90 H102 B2 N12 Nd2 O3 P2
• Title of publication: Neodymium(III) phosphinidene complexes supported by pentamethylcyclopentadienyl and hydrotris(pyrazolyl)borate ligands.
• Authors of publication: Cui, Peng; Chen, Yaofeng; Borzov, Maxim V.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 29
• Pages of publication: 6886 - 6890
• a: 11.9838 ± 0.0016 Å
• b: 14.2191 ± 0.0019 Å
• c: 14.739 ± 0.002 Å
• α: 98.263 ± 0.002°
• β: 109.668 ± 0.002°
• γ: 109.723 ± 0.002°
• Cell volume: 2130.4 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0727
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1247
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No