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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/opt Acetic_acidSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) GENECP-229.084611091; Eh
thumbnail.jpeg/opt [(NHC1)Pd(CH3CO2)]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.56310468; Eh
thumbnail.jpeg/opt [Isomer_I+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.56986593; Eh
thumbnail.jpeg/opt [Isomer_II+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.55870257; Eh
thumbnail.jpeg/opt [Isomer_III+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.55077562; Eh
thumbnail.jpeg/opt [Isomer_IV+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.56207419; Eh
thumbnail.jpeg/opt [Isomer_V+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.51785034; Eh
thumbnail.jpeg/opt [Isomer_Vd+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.52023914; Eh
thumbnail.jpeg/opt [Isomer_VI+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.52767851; Eh
thumbnail.jpeg/opt [Isomer_VII+CH3CO2H]+Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.52935881; Eh
thumbnail.jpeg/opt TS1Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.51746196; Eh
thumbnail.jpeg/opt TS2Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.51293984; Eh
thumbnail.jpeg/opt TS3Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.52444369; Eh
thumbnail.jpeg/opt TS4Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.51324728; Eh
thumbnail.jpeg/opt TS5Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.48340562; Eh
thumbnail.jpeg/opt TS5dSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.46048352; Eh
thumbnail.jpeg/opt TS6Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.48740980; Eh
thumbnail.jpeg/opt TS7Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1352.49910589; Eh
thumbnail.jpeg/opt Isomer_ISharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.43446833; Eh
thumbnail.jpeg/opt Isomer_IISharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.42216014; Eh
thumbnail.jpeg/opt Isomer_IIISharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.41772922; Eh
thumbnail.jpeg/opt Isomer_IVSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.42076133; Eh
thumbnail.jpeg/opt Isomer_VSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.39245629; Eh
thumbnail.jpeg/opt Isomer_VdSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.37714882; Eh
thumbnail.jpeg/opt Isomer_VISharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(D) LANL2DZ GENECP-1123.37795597; Eh
Results 1-25 of 84 (Search time: 0.021 seconds).