Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
about
Quantum chemistry: Quadruply bonded carbonA combined experimental and theoretical study on realizing and using laser controlled torsion of molecules.NCIPLOT: a program for plotting non-covalent interaction regions.Modeling biophysical and biological properties from the characteristics of the molecular electron density, electron localization and delocalization matrices, and the electrostatic potential.High-resolution neutron and X-ray diffraction room-temperature studies of an H-FABP-oleic acid complex: study of the internal water cluster and ligand binding by a transferred multipolar electron-density distribution.Quantitative analysis of intermolecular interactions in orthorhombic rubrene.Di-n-butyl-bis-[N-(2-meth-oxy-eth-yl)-N-methyl-dithio-carbamato-κ2S,S']tin(IV): crystal structure and Hirshfeld surface analysis.s-Block amidoboranes: syntheses, structures, reactivity and applications.Orientational Disorder in Adamantane and Adamantanecarboxylic Acid.On atom-atom 'short contact' bonding interactions in crystals.The enrichment ratio of atomic contacts in crystals, an indicator derived from the Hirshfeld surface analysis.High-pressure single crystal X-ray diffraction study of the linear metal chain compound Co3(dpa)4Br2·CH2Cl2.Isomorphism and solid solution as shown by an accurate high-resolution diffraction experiment.Formation of β-cyclodextrin complexes in an anhydrous environment.Effects of the protonation state in the interaction of an HIV-1 reverse transcriptase (RT) amino acid, Lys101, and a non nucleoside RT inhibitor, GW420867X.Structural and energetic properties of the potential HIV-1 reverse transcriptase inhibitors d4A and d4G: a comprehensive theoretical investigation.Conformational and NMR study of some furan derivatives by DFT methods.Hydrogen-bond cooperative effects in small cyclic water clusters as revealed by the interacting quantum atoms approach.Mono- and dinuclear osmium N,N'-di- and tetraphenylbipyridyls and extended bipyridyls. Synthesis, structure and electrochemistry.Revealing non-covalent interactions in solids: NCI plots revisited.Toward a consistent interpretation of the QTAIM: tortuous link between chemical bonds, interactions, and bond/line paths.Adaptive binding and selection of compressed 1,ω-diammonium-alkanes via molecular encapsulation in water.Interacting quantum fragments-rooted preorganized-interacting fragments attributed relative molecular stability of the Be(II) complexes of nitrilotriacetic acid and nitrilotri-3-propionic acid.A new approach to the design of neutral 10-C-5 trigonal-bipyramidal carbon compounds: a "π-electron cap" effect.σ-Hole bond versus hydrogen bond: from tetravalent to pentavalent N, P, and as atoms.Sodium compounds of the benzophenone dianion (diphenyloxidomethanide).Bay-type H···H "bonding" in cis-2-butene and related species: QTAIM versus NBO description.Forced bonding and QTAIM deficiencies: a case study of the nature of interactions in He@adamantane and the origin of the high metastability.Tetrel bond-σ-hole bond as a preliminary stage of the SN2 reaction.Well-defined molecular magnesium hydride clusters: relationship between size and hydrogen-elimination temperature.A Critical Check for the Role of Resonance in Intramolecular Hydrogen Bonding.Exploration of the forbidden regions of the Ramachandran plot (ϕ-ψ) with QTAIM.Weak Supramolecular Interactions Governing Parallel and Antiparallel DNA Quadruplexes: Insights from Large-Scale Quantum Mechanics Analysis of Experimentally Derived Models.Energetic analysis of conjugated hydrocarbons using the interacting quantum atoms method.Nature and Strength of the Inner-Core H⋅⋅⋅H Interactions in Porphyrinoids.The Role of the DNA Backbone in Minor-Groove Ligand Binding.Toward deformation densities for intramolecular interactions without radical reference states using the fragment, atom, localized, delocalized, and interatomic (FALDI) charge density decomposition scheme.The Elusive Structural Origin of Plastic Bending in Dimethyl Sulfone Crystals with Quasi-isotropic Crystal Packing.Assessing the attractive/repulsive force balance in axial cyclohexane C-Hax ···Yax contacts: A combined computational analysis in monosubstituted cyclohexanes.(H3N-BH3)4: the ammonia borane tetramer.
P2860
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P2860
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
description
2003 nî lūn-bûn
@nan
2003 թուականի Մայիսին հրատարակուած գիտական յօդուած
@hyw
2003 թվականի մայիսին հրատարակված գիտական հոդված
@hy
2003年の論文
@ja
2003年論文
@yue
2003年論文
@zh-hant
2003年論文
@zh-hk
2003年論文
@zh-mo
2003年論文
@zh-tw
2003年论文
@wuu
name
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@ast
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@en
type
label
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@ast
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@en
prefLabel
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@ast
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@en
P2093
P3181
P356
P1476
Hydrogen–Hydrogen Bonding: A Stabilizing Interaction in Molecules and Crystals
@en
P2093
Chérif F. Matta
Jesús Hernández-Trujillo
Richard F. W. Bader
Ting-Hua Tang
P304
P3181
P356
10.1002/CHEM.200204626
P407
P577
2003-05-09T00:00:00Z