Information card for entry 7045190

Structure parameters

• Formula: C54 H72 Ag2 N6 O6 Se2
• Calculated formula: C54 H72 Ag2 N6 O6 Se2
• SMILES: C1(N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)=[Se][Ag][Se]=C1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.N1(=[O][Ag]2(O1)ON(=[O]2)=O)=O
• Title of publication: Diverse silver(i) coordination chemistry with cyclic selenourea ligands.
• Authors of publication: Perras, Justin H.; Mezibroski, Stefan M. J.; Wiebe, Matthew A.; Ritch, Jamie S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 5
• Pages of publication: 1471 - 1478
• a: 17.6429 ± 0.0015 Å
• b: 12.6491 ± 0.001 Å
• c: 29.964 ± 0.002 Å
• α: 90°
• β: 94.126 ± 0.004°
• γ: 90°
• Cell volume: 6669.6 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No