Information card for entry 2219135

Structure parameters

• Chemical name: <i>catena</i>-Poly[bis[octakis(dimethyl sulfoxide)praseodymium(III)] hexa-μ~3~-sulfido-dodeca-μ~2~-sulfido-hexasulfidohexasilverhexamolybdenum]
• Formula: C32 H96 Ag6 Mo6 O16 Pr2 S40
• Calculated formula: C32 H96 Ag6 Mo6 O16 Pr2 S40
• SMILES: [Ag]1S[Mo]2([S-])[S]1[Ag]1(S2)S[Mo]2([S-])S[Ag]3([S]12)S[Mo]1([S-])S[Ag]2([S]13)S[Mo]1([S-])S[Ag]3([S]21)S[Mo]1([S-])S[Ag]2([S]31)S[Mo]([S-])(S2)[S-].CS(C)=[O][Pr]([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)[O]=S(C)C.CS(C)=[O][Pr]([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)[O]=S(C)C
• Title of publication: <i>catena</i>-Poly[bis[octakis(dimethyl sulfoxide)praseodymium(III)] hexa-μ~3~-sulfido-dodeca-μ~2~-sulfido-hexasulfidohexasilverhexamolybdenum]
• Authors of publication: Jiang, Zhengjing; Tang, Guodong; Li, Rongqing; Zhang, Yu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: m1100 - m1101
• a: 15.1808 ± 0.0015 Å
• b: 17.62 ± 0.0017 Å
• c: 19.96 ± 0.002 Å
• α: 89.912 ± 0.002°
• β: 89.768 ± 0.003°
• γ: 87.616 ± 0.003°
• Cell volume: 5334.3 ± 0.9 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0645
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes