Information card for entry 7704219

Structure parameters

• Chemical name: [Nd(Htp)2(BH4)]2
• Formula: C48 H88 B2 Nd2 P4
• Calculated formula: C48 H88 B2 Nd2 P4
• Title of publication: Synthesis and characterisation of light lanthanide bis-phospholyl borohydride complexes.
• Authors of publication: Liu, Jingjing; Nodaraki, Lydia E.; Cobb, Philip J.; Giansiracusa, Marcus J.; Ortu, Fabrizio; Tuna, Floriana; Mills, David P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 19
• Pages of publication: 6504 - 6511
• a: 20.3618 ± 0.0013 Å
• b: 12.8239 ± 0.0019 Å
• c: 20.685 ± 0.003 Å
• α: 90°
• β: 93.734 ± 0.01°
• γ: 90°
• Cell volume: 5389.8 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.254
• Residual factor for significantly intense reflections: 0.1188
• Weighted residual factors for significantly intense reflections: 0.2827
• Weighted residual factors for all reflections included in the refinement: 0.3781
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No