Information card for entry 1547215

Structure parameters

• Formula: C24 H46 N O2 P S2
• Calculated formula: C24 H46 N O2 P S2
• SMILES: S=P([S-])(O[C@@H]1[C@@]2(CC[C@H](C1(C)C)C2)C)O[C@@H]1[C@@]2(CC[C@H](C1(C)C)C2)C.[NH3+]C(C)(C)C
• Title of publication: Novel Gold(I) and Silver(I) Complexes of Phosphorus-1,1,-dithiolates and Molecular Structure of [O,O'-(Bornyl)2PS2]H3NC(CH3)3
• Authors of publication: Samet Solak; Cemal Aydemir; Mehmet Karakus; Peter Lonnecke
• Journal of publication: Chemistry Central Journal
• Year of publication: 2013
• Journal volume: 7
• Pages of publication: 89
• a: 10.2944 ± 0.0001 Å
• b: 13.6664 ± 0.0002 Å
• c: 19.4983 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2743.16 ± 0.06 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0403
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No