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Quantifying weak hydrogen bonding in uracil and 4-cyano-4'-ethynylbiphenyl: a combined computational and experimental investigation of NMR chemical shifts in the solid state.
Uldry AC, Griffin JM, Yates JR, Pérez-Torralba M, María MD, Webber AL, Beaumont ML, Samoson A, Claramunt RM, Pickard CJ, Brown SP. Uldry AC, et al. Among authors: claramunt rm. J Am Chem Soc. 2008 Jan 23;130(3):945-54. doi: 10.1021/ja075892i. Epub 2008 Jan 1. J Am Chem Soc. 2008. PMID: 18166050
NMR studies of ultrafast intramolecular proton tautomerism in crystalline and amorphous n,n'-diphenyl-6-aminofulvene-1-aldimine: solid-state, kinetic isotope, and tunneling effects.
Lopez del Amo JM, Langer U, Torres V, Buntkowsky G, Vieth HM, Pérez-Torralba M, Sanz D, Claramunt RM, Elguero J, Limbach HH. Lopez del Amo JM, et al. Among authors: claramunt rm. J Am Chem Soc. 2008 Jul 9;130(27):8620-32. doi: 10.1021/ja801506n. J Am Chem Soc. 2008. PMID: 18597427
6-Aminofulvene-1-aldimine: A Model Molecule for the Study of Intramolecular Hydrogen Bonds We are indebted to DGES/MEC (PB96-0001-C03) and Comunidad de Madrid (grant no. 07N/0001/1999) of Spain for financial support and to Dr. Ibon Alkorta for carrying out the B3LYP/6-31G calculations.
Claramunt RM, Sanz D, Alarcón SH, Pérez Torralba M, Elguero J, Foces-Foces C, Pietrzak M, Langer U, Limbach HH. Claramunt RM, et al. Angew Chem Int Ed Engl. 2001 Jan 19;40(2):420-423. Angew Chem Int Ed Engl. 2001. PMID: 11180344 No abstract available.