Information card for entry 7710567

Structure parameters

• Common name: DG117
• Formula: C24 H38 Bi2 N4 O2
• Calculated formula: C24 H38 Bi2 N4 O2
• Title of publication: Organopnictogen(III) bis(arylthiolates) containing NCN-aryl pincer ligands: from synthesis and characterization to reactivity
• Authors of publication: Duneș, Gabriel; Soran, Albert; Silvestru, Cristian
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 6.4357 ± 0.0004 Å
• b: 9.7886 ± 0.0006 Å
• c: 11.9131 ± 0.0007 Å
• α: 67.762 ± 0.002°
• β: 89.344 ± 0.002°
• γ: 78.893 ± 0.002°
• Cell volume: 680.09 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0094
• Residual factor for significantly intense reflections: 0.009
• Weighted residual factors for significantly intense reflections: 0.0201
• Weighted residual factors for all reflections included in the refinement: 0.0203
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No