Information card for entry 7041894

Structure parameters

• Formula: C19 H21 Au N2 O5 P
• Calculated formula: C19 H21 Au N2 O5 P
• SMILES: [Au]([P](c1occc1)(c1occc1)c1occc1)C1=N(=O)C(C([N]1=O)(C)C)(C)C
• Title of publication: An efficient synthetic method for organometallic radicals: structures and properties of gold(i)-(nitronyl nitroxide)-2-ide complexes.
• Authors of publication: Suzuki, Shuichi; Kira, Sayaka; Kozaki, Masatoshi; Yamamura, Masaki; Hasegawa, Toru; Nabeshima, Tatsuya; Okada, Keiji
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 8
• Pages of publication: 2653 - 2659
• a: 12.636 ± 0.01 Å
• b: 12.676 ± 0.01 Å
• c: 14.952 ± 0.011 Å
• α: 66.34 ± 0.03°
• β: 70.68 ± 0.04°
• γ: 72.25 ± 0.03°
• Cell volume: 2029 ± 3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 200 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 significantly intense reflections: 0.0364
• Weighted residual factors for all reflections included in the refinement: 0.0294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No