Information card for entry 2016625

Structure parameters

• Common name: [(k2-N2-Bp)Mg(THF)]
• Chemical name: bis[dihydridobis(pyrazol-1-yl)borato-κ^2^<i>N</i>,<i>N</i>'](tetrahydrofuran- κO)magnesium(II)
• Formula: C16 H24 B2 Mg N8 O
• Calculated formula: C16 H24 B2 Mg N8 O
• SMILES: [Mg]12([O]3CCCC3)([n]3n([BH2]n4[n]1ccc4)ccc3)[n]1n([BH2]n3[n]2ccc3)ccc1
• Title of publication: Polymeric [dihydrobis(pyrazol-1-yl)borato]potassium(I) and three dihydrobis(pyrazol-1-yl)borate‒magnesium(I) compounds obtained by disproportionation of the Grignard reagent
• Authors of publication: Loroño-Gonzalez, D. J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: m228 - m232
• a: 9.951 ± 0.003 Å
• b: 10.741 ± 0.002 Å
• c: 20.996 ± 0.003 Å
• α: 99.137 ± 0.005°
• β: 97.41 ± 0.004°
• γ: 107.909 ± 0.003°
• Cell volume: 2070.2 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0841
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections included in the refinement: 0.1152
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes