Information card for entry 4086988

Structure parameters

• Formula: C118 H117 Ag7 F12 O21 P6 S4
• Calculated formula: C118 H117 Ag7 F12 O21 P6 S4
• SMILES: [C]12(#Cc3ccc(cc3)OC)[Ag]3[P](c4ccccc4)(c4ccccc4)C4[P](c5ccccc5)(c5ccccc5)[Ag]5[C]6(#Cc7ccc(cc7)OC)[Ag]7[P](c8ccccc8)(c8ccccc8)C8[P](c9ccccc9)(c9ccccc9)[Ag]2(OS(=O)(=O)C(F)(F)F)[Ag]2913567[C](#Cc1ccc(cc1)OC)([Ag]2[P]4(c1ccccc1)c1ccccc1)[Ag]9[P]8(c1ccccc1)c1ccccc1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].CO.CO.CC(=O)C.CO.CC(=O)C.CCOCC
• Title of publication: Silver Alkynyl-Phosphine Clusters: An Electronic Effect of the Alkynes Defines Structural Diversity
• Authors of publication: Chen, Yi-Ting; Krytchankou, Ilya S.; Karttunen, Antti J.; Grachova, Elena V.; Tunik, Sergey P.; Chou, Pi-Tai; Koshevoy, Igor O.
• Journal of publication: Organometallics
• Year of publication: 2017
• Journal volume: 36
• Journal issue: 2
• Pages of publication: 480
• a: 14.618 ± 0.0004 Å
• b: 20.217 ± 0.0005 Å
• c: 22.3293 ± 0.0006 Å
• α: 81.432 ± 0.001°
• β: 76.26 ± 0.001°
• γ: 73.098 ± 0.001°
• Cell volume: 6110.6 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0605
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No