Information card for entry 7226266

Structure parameters

• Formula: C28 H30 Au2 Cl2 N4 P2
• Calculated formula: C28 H30 Au2 Cl2 N4 P2
• SMILES: c1cccc(n1)[P]1(CN(C[P](c2ccccn2)(CN(C1)c1ccc(cc1)C)[Au]Cl)c1ccc(cc1)C)[Au]Cl
• Title of publication: A stimuli-responsive Au(i) complex based on an aminomethylphosphine template: synthesis, crystalline phases and luminescence properties
• Authors of publication: Strelnik, Igor D.; Gurzhiy, Vladislav V.; Sizov, Vladimir V.; Musina, Elvira I.; Karasik, Andrey A.; Tunik, Sergey P.; Grachova, Elena V.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 39
• Pages of publication: 7629
• a: 15.3277 ± 0.0005 Å
• b: 8.872 ± 0.0002 Å
• c: 14.8008 ± 0.0006 Å
• α: 90°
• β: 112.309 ± 0.004°
• γ: 90°
• Cell volume: 1862.07 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0508
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No