Information card for entry 2227858

Structure parameters

• Chemical name: Poly[bis(μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>')(μ~2~- thiocyanato-κ^2^<i>N</i>:<i>S</i>)(4'-<i>p</i>-tolyl-2,2':6',2''-terpyridine- κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')cadmium(II)silver(I)]
• Formula: C25 H17 Ag Cd N6 S3
• Calculated formula: C25 H17 Ag Cd N6 S3
• SMILES: [Cd]1234([n]5c(c6[n]1c(c1[n]2cccc1)cc(c1ccc(C)cc1)c6)cccc5)[N]#C[S]1[Ag](SC#[N]3)([S]2[Ag]1SC#[N][Cd]13([n]5c(c6[n]1c(c1[n]3cccc1)cc(c1ccc(C)cc1)c6)cccc5)([N]#C2)N=C=S)SC#[N][Cd]123([n]5c(c6[n]1c(c1[n]2cccc1)cc(c1ccc(C)cc1)c6)cccc5)[N]#C[S]1[Ag](SC#[N]4)(SC#[N]3)[S]2[Ag]1SC#[N][Cd]13([n]4c(c5[n]1c(c1[n]3cccc1)cc(c1ccc(C)cc1)c5)cccc4)([N]#C2)N=C=S
• Title of publication: Poly[bis(μ~3~-thiocyanato-κ^3^<i>N</i>:<i>S</i>:<i>S</i>')(μ~2~-thiocyanato-κ^2^<i>N</i>:<i>S</i>)(4'-<i>p</i>-tolyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')cadmium(II)silver(I)]
• Authors of publication: Li, Yu-Yang; Wei, Zhen-Hong; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: m1313 - m1314
• a: 10.2431 ± 0.001 Å
• b: 10.7881 ± 0.001 Å
• c: 13.118 ± 0.0012 Å
• α: 73.045 ± 0.002°
• β: 69 ± 0.002°
• γ: 88.231 ± 0.002°
• Cell volume: 1290.1 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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 all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes