Information card for entry 7718417

Structure parameters

• Formula: C76 H112 Bi2 I2 N4 O6
• Calculated formula: C76 H112 Bi2 I2 N4 O6
• Title of publication: A tridentate and dianionic N-heterocyclic olefin (NHO) with two unsymmetrically-tethered aryloxide sidearms on bismuth: a fortuitous followed by systematic discovery.
• Authors of publication: Goswami, Santu; Sarkar, Subham; Guha Roy, Anisha; Mallick, Dibyendu; Mukherjee, Debabrata
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 20
• Pages of publication: 8142 - 8151
• a: 10.814 ± 0.0002 Å
• b: 13.8767 ± 0.0002 Å
• c: 15.9783 ± 0.0003 Å
• α: 98.201 ± 0.001°
• β: 106.435 ± 0.002°
• γ: 99.412 ± 0.001°
• Cell volume: 2223.14 ± 0.07 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0487
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No