Information card for entry 4119087

Structure parameters

• Common name: tetraphenylarsonium Pb(II) iso-maleonitriledithiolate
• Formula: C112 H80 As4 N8 Pb2 S8
• Calculated formula: C112 H80 As4 N8 Pb2 S8
• Title of publication: Reexamination of Lead(II) Coordination Preferences in Sulfur-Rich Sites: Implications for a Critical Mechanism of Lead Poisoning
• Authors of publication: Magyar, John S.; Weng, Tsu-Chien; Stern, Charlotte M.; Dye, David F.; Rous, Brian W.; Payne, John C.; Bridgewater, Brian M.; Mijovilovich, Ana; Parkin, Gerard; Zaleski, Jeffrey M.; Penner-Hahn, James E.; Godwin, Hilary Arnold
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Journal issue: 26
• Pages of publication: 9495 - 9505
• a: 11.914 ± 0.002 Å
• b: 13.355 ± 0.002 Å
• c: 16.927 ± 0.003 Å
• α: 80.618 ± 0.003°
• β: 77.022 ± 0.003°
• γ: 73.653 ± 0.003°
• Cell volume: 2504 ± 0.7 ų
• Cell temperature: 153.2 K
• Ambient diffraction temperature: 153.2 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: 0.0607
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for all reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.054
• Goodness-of-fit parameter for all reflections: 1.455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.53
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No