Information card for entry 1562124

Structure parameters

• Formula: C95 H118 Au2 Cl2 F12 N12 O6 P2
• Calculated formula: C95 H118 Au2 Cl2 F12 N12 O6 P2
• Title of publication: Covalent and non-covalent albumin binding of Au(i) bis-NHCs <i>via</i> post-synthetic amide modification.
• Authors of publication: Sen, Sajal; Perrin, Mark W.; Sedgwick, Adam C.; Lynch, Vincent M.; Sessler, Jonathan L.; Arambula, Jonathan F.
• Journal of publication: Chemical science
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 21
• Pages of publication: 7547 - 7553
• a: 11.0621 ± 0.0002 Å
• b: 18.0164 ± 0.0003 Å
• c: 25.9531 ± 0.0005 Å
• α: 102.579 ± 0.002°
• β: 92.799 ± 0.001°
• γ: 98.359 ± 0.001°
• Cell volume: 4977.26 ± 0.16 ų
• Cell temperature: 100.04 ± 0.11 K
• Ambient diffraction temperature: 100.04 ± 0.11 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No