Information card for entry 7106788

Structure parameters

• Common name: bis(tetrahydrofuranlithium) tris(N,N'diphenylhydrazido)manganate(IV)
• Chemical name: bis(tetrahydrofuranlithium) tris(N,N'diphenylhydrazido)manganate(IV)
• Formula: C44 H46 Li2 Mn N6 O2
• Calculated formula: C44 H46 Li2 Mn N6 O2
• SMILES: c1c(cccc1)[N]1([Li]2[O]3CCCC3)[Mn]34([N]2(c2ccccc2)[N]32c3ccccc3)(N1c1ccccc1)N(c1ccccc1)[N]4(c1ccccc1)[Li]2[O]1CCCC1
• Title of publication: An isolable, metastable, geometrically unique manganese(IV) trihydrazide complex poised for reactivity
• Authors of publication: Shivaiah Vaddypally; Sandeep K.Kondaveeti; Michael Zdilla
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 9696
• a: 12.025 ± 0.0007 Å
• b: 17.531 ± 0.001 Å
• c: 18.7595 ± 0.0011 Å
• α: 90°
• β: 95.103 ± 0.001°
• γ: 90°
• Cell volume: 3939 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0468
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0835
• Weighted residual factors for all reflections included in the refinement: 0.0897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No