Information card for entry 7715008

Structure parameters

• Formula: C20 H26 Au B Cl4 N6 O2 Se W
• Calculated formula: C20 H26 Au B Cl4 N6 O2 Se W
• SMILES: [W]123([Au](C=1[Se]CCl)Cl)(C#[O])([n]1c(C)cc(n1[BH](n1[n]2c(cc1C)C)n1[n]3c(C)cc1C)C)C#[O].ClCCl
• Title of publication: Stable cyclopropenylvinyl ligands <i>via</i> insertion into a transient cyclopropenyl metal bond.
• Authors of publication: Watson, Lachlan J.; Hill, Anthony F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 8
• Pages of publication: 3629 - 3637
• a: 14.1718 ± 0.0003 Å
• b: 15.5447 ± 0.0004 Å
• c: 15.4562 ± 0.0004 Å
• α: 90°
• β: 106.216 ± 0.002°
• γ: 90°
• Cell volume: 3269.48 ± 0.14 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 9
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No