Information card for entry 7025521

Structure parameters

• Formula: C15 H36 Ag Cl N6 S3
• Calculated formula: C15 H36 Ag Cl N6 S3
• SMILES: [Ag](Cl)([S]=C(NCC)NCC)([S]=C(NCC)NCC)[S]=C(NCC)NCC
• Title of publication: Structural and spectroscopic studies of some adducts of silver(I) halides with thiourea and N-ethyl substituted thioureas.
• Authors of publication: Bowmaker, Graham A.; Pakawatchai, Chaveng; Saithong, Saowanit; Skelton, Brian W.; White, Allan H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 18
• Pages of publication: 4391 - 4404
• a: 13.2924 ± 0.0006 Å
• b: 13.4749 ± 0.0006 Å
• c: 16.3116 ± 0.0007 Å
• α: 74.412 ± 0.004°
• β: 74.071 ± 0.004°
• γ: 63.333 ± 0.004°
• Cell volume: 2474.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.107
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.1042
• Goodness-of-fit parameter for all reflections included in the refinement: 0.899
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No