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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-nch33_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-329.608659209; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3och3 ch3och3-oTs_6311+Gd_ch2cl2-2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-1050.18470078; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3cn ch3cn-nh2_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-188.834439378; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3cn ch3cn-och2ch3_6311+Gd_ch2cl2spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-287.375843979; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nch33 ch3nch33-sch3_6311+Gd_ch2cl2-3spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-652.579136893; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nh2 ch3nh2-c6h5_6311+Gd_ch2cl21Morán, LucíaGaussian; 16; AM64L-G16RevA.03Single point Structure-6-311+G(D)-327.641533621; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nh2 ch3nh2-nhcho_6311+Gd_ch2cl2-1spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G(D)-265.345435264; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nh2 ch3nh2-cn_6311+Gd_ch2cl22Morán, LucíaGaussian; 16; AM64L-G16RevA.03Single point Structure-6-311+G(D)-188.875528231; Eh
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nch33 ch3nch33-i_6311+Gd_ch2cl2-3spMorán, LucíaGaussian; 16; AM64L-G16RevA.03Single point StructureRB3LYP6-311+G* GENECP-
thumbnail.jpeg30-Sep-2021/DCM/adducts_DCM/add_ch3nh2 ch3nh2-ph2_6311+Gd_ch2cl22Morán, LucíaGaussian; 16; AM64L-G16RevA.03Single point Structure-6-311+G(D)-438.554922336; Eh
Results 11-20 of 388 (Search time: 0.002 seconds).