Information card for entry 4102511

Structure parameters

• Common name: [NBu4][ToMZn(Cl)N(SiHMe2)2]
• Chemical name: [NBu4]chloro tris(4,4-Me-2-oxazolinyl)phenylborato tetramethyldisilazato zinc
• Formula: C41 H79 B Cl N5 O3 Si2 Zn
• Calculated formula: C41 H79 B Cl N5 O3 Si2 Zn
• SMILES: [Zn]1(Cl)([N]2C(C)(C)COC=2[B](C2=[N]1C(CO2)(C)C)(C1=NC(CO1)(C)C)c1ccccc1)N([SiH](C)C)[SiH](C)C.C(CCC)[N+](CCCC)(CCCC)CCCC
• Title of publication: Conversion of a Zinc Disilazide to a Zinc Hydride Mediated by LiCl
• Authors of publication: Debabrata Mukherjee; Arkady Ellern; Aaron D. Sadow
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 7582 - 7583
• a: 21.8574 ± 0.0009 Å
• b: 14.4461 ± 0.0006 Å
• c: 15.6143 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4930.3 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No