About: A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors

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scientific article published on 01 February 2019

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rdf:type	Item
description	wetenschappelijk artikel (nl) bài báo khoa học (vi) artículu científicu espublizáu en febreru de 2019 (ast) articolo scientifico (pubblicato il 2019) (it) artikull shkencor i botuar më 01 shkurt 2019 (sq) scientific article published on 01 February 2019 (en) наукова стаття, опублікована 1 лютого 2019 (uk)
publication date	wds:Q91052587-105A0FEB-F719-4CD2-8D5F-291A80D499F6
publication date	2019-02-01 00:00:00Z (xsd:dateTime)
cites work	wds:Q91052587-05F928F9-25F8-4BBA-A656-784A057BA3AE wds:Q91052587-0624CF7E-6AEC-428D-8098-FD1C8B66368C wds:Q91052587-0C5A0731-CFBC-4FE9-94D5-4F09751C83B7 wds:Q91052587-1800D03D-9117-4DB0-B63F-00DF76050B14 wds:Q91052587-1CF87035-5BF8-49D9-A91C-E2DA05E8C189 wds:Q91052587-2336777C-F69B-40AE-A215-4B7B06D06E29 wds:Q91052587-308C026F-B168-4A0F-B8D9-B9EB7AA08077 wds:Q91052587-43E502FB-F4D2-43AD-BDAF-F511CA4FD636 wds:Q91052587-540DA890-BDC6-47B5-B457-B0F88BCFD082 wds:Q91052587-57CB3348-2996-4534-AE38-EAF132D91F6B wds:Q91052587-57FB8296-45E5-459A-9366-3BBC08C74403 wds:Q91052587-61EA949E-002D-4B20-84E7-FEA50E646D23 wds:Q91052587-63A6527D-4D49-4077-A712-8B00937FE661 wds:Q91052587-63FDFC56-E8AD-44EB-8BFF-7BCF311549FF wds:Q91052587-6497864F-1D1A-4584-B922-E195B97C3C70 wds:Q91052587-72420218-8A71-490C-81FF-309909E3B1A8 wds:Q91052587-7C96B8B2-7F6F-46B3-AA5F-0D20D125884D wds:Q91052587-80F273E8-16B3-40BC-BA85-44F0BC625474 wds:Q91052587-83B94ED4-9F97-4EF7-B4D0-AEBAF119093B wds:Q91052587-8CBAB201-7B9A-4911-A494-8FCB9186280E wds:Q91052587-9398FD66-84C4-4FDB-9B00-05B634B20618 wds:Q91052587-B7FD0D76-3C5D-4994-8C74-ABB31D6232B1 wds:Q91052587-B8BDD1EC-A67E-4269-9636-6E72B60A9ADC wds:Q91052587-C977D2AA-3665-4868-99B9-8D7F8A86F9AF wds:Q91052587-CB7282E6-6F44-489E-8FA8-3903D020309E wds:Q91052587-CF74BFAC-8257-4956-883F-1603FBE2C433 wds:Q91052587-D2CBD524-CE90-4AC8-9043-897C4A766E97 wds:Q91052587-DCC11991-5D63-46FF-BB48-3631D7C2BA18 wds:Q91052587-EFB517C4-0AF1-42C0-909F-C92E6C4EA770 wds:Q91052587-F1D93356-5057-45F3-991E-A77A2F83C337
cites work	A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu Density-functional approaches to noncovalent interactions: A comparison of dispersion corrections (DFT-D), exchange-hole dipole moment (XDM) theory, and specialized functionals Density-functional exchange-energy approximation with correct asymptotic behavior The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors Study of the N−H···H−B Dihydrogen Bond Including the Crystal Structure of BH 3 NH 3 by Neutron Diffraction Halogen bonding and other σ-hole interactions: a perspective Valency and Bonding Density-functional approximation for the correlation energy of the inhomogeneous electron gas Ab initio studies of hydrogen bonds: the water dimer paradigm Correlations between the solvent hydrogen bond acceptor parameter .beta. and the calculated molecular electrostatic potential What is the covalency of hydrogen bonding? Mathematical modeling and physical reality in noncovalent interactions. Halogen bonding: an electrostatically-driven highly directional noncovalent interaction Optimized Slater-type basis sets for the elements 1-118. Chemistry with ADF Blue-Shifting Hydrogen Bonds. What is a hydrogen bond? Mutually consistent theoretical and experimental criteria for characterizing H-bonding interactions Ab initio investigation of the complexes between bromobenzene and several electron donors: some insights into the magnitude and nature of halogen bonding interactions. The accuracy of DFT-optimized geometries of functional transition metal compounds: a validation study of catalysts for olefin metathesis and other reactions in the homogeneous phase The boron–boron single bond in diborane(4) as a non-classical electron donor for hydrogen bonding Hydrogen-Bonding Acceptor Character of Be3, the Beryllium Three-Membered Ring. Halogen bonding: an interim discussion An Unconventional Intermolecular Three-Center N–H… H2Re Hydrogen Bond in Crystalline[ReH5(PPh3)3]·indole·C6H6 Hydrogen bonds, and σ-hole and π-hole bonds - mechanisms protecting doublet and octet electron structures. Non-alkane behavior of cyclopropane and its derivatives: characterization of unconventional hydrogen bond interactions A perspective on quantum mechanics and chemical concepts in describing noncovalent interactions Jmol SMILES and Jmol SMARTS: specifications and applications Hydrogen bonds with pi and sigma electrons as the multicenter proton acceptors: high level ab initio calculations The infrared spectrum of the H2–HCO+ complex The Hellmann-Feynman theorem: a perspective
rdfs:label	A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (en) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (nl) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (sq)
skos:prefLabel	A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (en) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (nl) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (sq)
name	A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (en) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (nl) A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (sq)
author	wds:Q91052587-8967FA19-625D-4CBA-AD47-AE228EC7BB54
author	Sławomir J Grabowski
title	wds:Q91052587-A21EC845-EA44-40A2-A60E-5E1E41027CB6
title	A-H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors (en)
page(s)	wds:Q91052587-AE11D334-FDA4-4B71-98D3-DA83D32F4384
page(s)	565-574
instance of	wds:Q91052587-559FF302-EAFA-4427-BDB0-78F9170126D5
instance of	scholarly article
PubMed ID	wds:Q91052587-D80B541A-F445-4FCF-AA9D-6ED169E75D72
PubMed ID	http://rdf.ncbi.nlm.nih.gov/pubchem/reference/30645024
PubMed ID	30645024
published in	wds:Q91052587-7209D6B2-BA42-4E6F-81B3-0234E98E455B
published in	ChemPhysChem
issue	wds:Q91052587-ABD6040A-5D22-4F6C-A120-988F21D1D96B
volume	wds:Q91052587-3F0EA515-607D-4072-9F9E-DF4963017138
issue	4
volume	20
DOI	wds:Q91052587-64182989-0076-4163-B5FF-6D0EB013295D
DOI	http://dx.doi.org/10.1002/CPHC.201900045
DOI	10.1002/CPHC.201900045
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q91052587

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