Information card for entry 4062572

Structure parameters

• Common name: (dimethylsilyl)(dimethylchlorosilyl)niobocene hydrid
• Chemical name: bis(cyclopentadienyl)(dimethylsilyl) (dimethylchlorosilyl)(hydrido) niobium (V)
• Formula: C14.01 H23.03 Cl Nb Si2
• Calculated formula: C14.008 H23.032 Cl Nb Si2
• Title of publication: Neutron and X-ray Diffraction Studies and DFT Calculations of Asymmetric Bis(silyl) Niobocene Hydrides
• Authors of publication: Dorogov, Konstantin Yu.; Dumont, Elise; Ho, Nam-Nhat; Churakov, Andrei V.; Kuzmina, Lyudmila G.; Poblet, Josep-Maria; Schultz, Arthur J.; Howard, Judith A. K.; Bau, Robert; Lledos, Agusti; Nikonov, Georgii I.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 12
• Pages of publication: 2845 - 2847
• a: 13.6876 ± 0.0004 Å
• b: 8.5767 ± 0.0003 Å
• c: 14.5354 ± 0.0004 Å
• α: 90°
• β: 93.627 ± 0.002°
• γ: 90°
• Cell volume: 1702.96 ± 0.09 ų
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Goodness-of-fit parameter for all reflections: 1.43
• Method of determination: powder diffraction
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No