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Journal of Molecular Structure(2)
Journal of Chemical Crystallography(1)
Molecular Crystals and Liquid Crystals(1)
Crystal Structure Analysis and Topological Study of Non-covalent Interactions in 2,2-Biimidazole:Salicylic Acid 2:1 Co-crystal
ArticleAbstract: Abstract: The 1:2 ratio salicylic acid/biimidazole co-crystal is studied in this work. I This compouPalabras claves:Crystal structure, DFT calculations, Hydrogen bonds, NCI analysisAutores:Almeida R., Atencio R., Bruno-Colmenarez J., Luis E. Seijas, Luis Rincon, Quintero M.Fuentes:scopusCrystal structure of 2-thiohydantoin-L-isoleucine synthesized under solvent-free conditions
ArticleAbstract: The title compound with systematic name: (S)-5-secbutyl-2-thiohydantoin, is synthesized through a soPalabras claves:Crystal structure, Hydrogen bonds, ThiohydantoinAutores:Almeida R., Delgado G.E., Gonzalez T., Luis E. Seijas, Mora A.J.Fuentes:scopusOn the energetic and structure of 2-piperidinic acid
Conference ObjectAbstract: In this paper we investigate, by means of ab initio (RHF) and density functional theory calculationsPalabras claves:2-Piperidinic acid, Ab initio calculation, Density functional theory calculations, Hydrogen bond, X-ray structureAutores:Almeida R., Bahsas A., Cuervo J., Delgado G.E., Luis Rincon, Mora A.J.Fuentes:googlescopusThe role of H-bonding in the structure of the 4-piperidinecarboxylic acid monohydrate
Conference ObjectAbstract: In this work we have investigated the hydrogen bond scheme of 4-piperidinecarboxylic (isonipecotic)Palabras claves:Hydrogen bond, Piperidinecarboxylic acids, Semi-empirical calculations, X-ray structureAutores:Almeida R., Bahsas A., Cuervo J., Delgado G.E., Luis Rincon, Mora A.J., Ramírez B.Fuentes:googlescopus