Information card for entry 7705767

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: 26.48 ± 0.01 Å
• b: 9.257 ± 0.003 Å
• c: 16.494 ± 0.008 Å
• α: 90°
• β: 100.343 ± 0.008°
• γ: 90°
• Cell volume: 3977 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0824
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No