Information card for entry 7705766

Structure parameters

• Formula: C18 H28 B N Ni2 O Si
• Calculated formula: C18 H28 B N Ni2 O Si
• SMILES: [Ni]123456(C(=O)[Ni]789%102(B1N(C(C)(C)C)[Si](C)(C)C)[cH]1[cH]7[cH]8[cH]9[cH]%101)[cH]1[cH]3[cH]4[cH]5[cH]61
• Title of publication: Intermetallic transfer of unsymmetrical borylene fragments: isolation of the second early-transition-metal terminal borylene complex and other rare species.
• Authors of publication: Macha, Bret B.; Dhara, Debabrata; Radacki, Krzysztof; Dewhurst, Rian D.; Braunschweig, Holger
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 48
• Pages of publication: 17719 - 17724
• a: 12.436 ± 0.003 Å
• b: 9.8525 ± 0.0018 Å
• c: 16.497 ± 0.003 Å
• α: 90°
• β: 96.081 ± 0.014°
• γ: 90°
• Cell volume: 2009.9 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No