A Domino Process towards Functionally Dense Quaternary Carbons through Pd-Catalyzed Decarboxylative Csp3-Csp3 Bond Formation Collection home page

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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-1-62

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Collection's Items (Sorted by Submit Date in Descending order): 1 to 20 of 73
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Jan-2018t9´Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3197.68978105; Eh
thumbnail.jpeg29-Jan-2018t8´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3504.75286077; Eh
thumbnail.jpeg29-Jan-2018t8´Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3197.69348232; Eh
thumbnail.jpeg29-Jan-2018t_2-2a_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31g(d); SDD-3077.72356294; Eh
thumbnail.jpeg29-Jan-2018t_2-2aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31g(d); SDD-2924.19507973; Eh
thumbnail.jpeg29-Jan-2018t11´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3504.75768492; Eh
thumbnail.jpeg29-Jan-2018t11´Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3197.69858001; Eh
thumbnail.jpeg29-Jan-2018t10´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3504.75381686; Eh
thumbnail.jpeg29-Jan-2018t10´Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3197.69270090; Eh
thumbnail.jpeg29-Jan-2018t9´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3504.75103608; Eh
thumbnail.jpeg29-Jan-2018t2_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3077.73994882; Eh
thumbnail.jpeg29-Jan-2018D_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d)-1230.95522540; Eh
thumbnail.jpeg29-Jan-2018t2aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-2924.20195268; Eh
thumbnail.jpeg29-Jan-2018DKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d)-923.902308690; Eh
thumbnail.jpeg29-Jan-2018t2Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-2924.21028595; Eh
thumbnail.jpeg29-Jan-2018M2´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d)-615.483745571; Eh
thumbnail.jpeg29-Jan-2018t_10´-11´Kuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31g(d); SDD-3197.68406091; Eh
thumbnail.jpeg29-Jan-2018M2_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d)-615.486637560; Eh
thumbnail.jpeg29-Jan-2018t_10´-11´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-31g(d); SDD-3504.74410128; Eh
thumbnail.jpeg29-Jan-2018t12´_napKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31g(d); SDD-3504.75359055; Eh
Collection's Items (Sorted by Submit Date in Descending order): 1 to 20 of 73
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