About: Defining the hydrogen bond: An account (IUPAC Technical Report)

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	The term %22hydrogen bond%22 has been used in the literature for nearly a century now. While its importance has been realized by physicists, chemists, biologists, and material scientists, there has been a continual debate about what this term means. This debate has intensified following some important experimental results, especially in the last decade, which questioned the basis of the traditional view on hydrogen bonding. Most important among them are the direct experimental evidence for a partial covalent nature and the observation of a blue-shift in stretching frequency following X-H center dot center dot center dot Y hydrogen bond formation (XH being the hydrogen bond donor and Y being the hydrogen bond acceptor). Considering the recent experimental and theoretical advances, we have proposed a new definition of the hydrogen bond, which emphasizes the need for evidence. A list of criteria has been provided, and these can be used as evidence for the hydrogen bond formation. This list is followed by some characteristics that are observed in typical hydrogen-bonding environments. The term %22hydrogen bond%22 has been used in the literature for nearly a century now. While its importance has been realized by physicists, chemists, biologists, and material scientists, there has been a continual debate about what this term means. This debate has intensified following some important experimental results, especially in the last decade, which questioned the basis of the traditional view on hydrogen bonding. Most important among them are the direct experimental evidence for a partial covalent nature and the observation of a blue-shift in stretching frequency following X-H center dot center dot center dot Y hydrogen bond formation (XH being the hydrogen bond donor and Y being the hydrogen bond acceptor). Considering the recent experimental and theoretical advances, we have proposed a new definition of the hydrogen bond, which emphasizes the need for evidence. A list of criteria has been provided, and these can be used as evidence for the hydrogen bond formation. This list is followed by some characteristics that are observed in typical hydrogen-bonding environments. (en)
Title	Defining the hydrogen bond: An account (IUPAC Technical Report) Defining the hydrogen bond: An account (IUPAC Technical Report) (en)
skos:prefLabel	Defining the hydrogen bond: An account (IUPAC Technical Report) Defining the hydrogen bond: An account (IUPAC Technical Report) (en)
skos:notation	RIV/61388963:_____/11:00389731!RIV13-AV0-61388963
http://linked.open...avai/predkladatel	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...avai/riv/aktivita	Z
http://linked.open...avai/riv/aktivity	Z(AV0Z40550506)
http://linked.open...iv/cisloPeriodika	8
http://linked.open...vai/riv/dodaniDat	2013
http://linked.open...aciTvurceVysledku	Hobza, Pavel
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku	193113
http://linked.open...ai/riv/idVysledku	RIV/61388963:_____/11:00389731
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	bonding; electrostatic interactions; hydrogen bonding; molecular interactions (en)
http://linked.open.../riv/klicoveSlovo	bonding electrostatic interactions hydrogen bonding molecular interactions
http://linked.open...odStatuVydavatele	US - Spojené státy americké
http://linked.open...ontrolniKodProRIV	[CDAE39DDD58B]
http://linked.open...i/riv/nazevZdroje	Pure and Applied Chemistry
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	14 (xsd:int)
http://linked.open...UplatneniVysledku	2011
http://linked.open...v/svazekPeriodika	83
http://linked.open...iv/tvurceVysledku	Hobza, Pavel Alkorta, I. Arunan, E. Clary, D. C. Crabtree, R. H. Dannenberg, J. J. Desiraju, G. R. Kjaergaard, H. G. Klein, R. A. Legon, A. C. Mennucci, B. Nesbitt, D. J. Sadlej, J. Scheiner, S.
http://linked.open...ain/vavai/riv/wos	000298741500009
http://linked.open...n/vavai/riv/zamer	Regulace biologických procesů: Chemické modulátory vybraných systémů významných pro medicínu a zemědělství
issn	0033-4545
number of pages	18 (xsd:int)
http://bibframe.org/vocab/doi	10.1351/PAC-REP-10-01-01
is http://linked.open...avai/riv/vysledek of	Defining the hydrogen bond: An account (IUPAC Technical Report)

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