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2-α-hydroxyalkyl- and 2,7-di(α-hydroxyalkyl)-1,8-bis(dimethylamino)naphthalenes:: Stabilization of nonconventional in/out conformers of proton sponges via N...H-O intramolecular hydrogen bonding.: A remarkable kind of tandem nitrogen inversion
Alexander F. Pozharskii et al.
JOURNAL OF ORGANIC CHEMISTRY (2007)
Qualitative analysis of the geometry of the hydrogen bond in the homoconjugated pyridine ion
I. G. Shenderovich
RUSSIAN JOURNAL OF GENERAL CHEMISTRY (2007)
How the shape of the NH2 group depends on the substituent effect and H-bond formation in derivatives of aniline
Halina Szatylowicz et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Geometrical features of hydrogen bonded complexes involving sterically hindered pyridines
Daria V. Andreeva et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Hydrogen-bond symmetry in zwitterionic phthalate anions: Symmetry breaking by solvation
Charles L. Perrin et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
Cooperativity in hydrogen-bonded interactions:: Ab initio and atoms in molecules analyses
Marcin Ziolkowski et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Probing the low-barrier hydrogen bond in hydrogen maleate in the gas phase: A photoelectron spectroscopy and ab initio study
HK Woo et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Quantum mechanical continuum solvation models
J Tomasi et al.
CHEMICAL REVIEWS (2005)
Crystal structure of cesium dihydrotrifluoride, CsH2F3. refinement of the crystal structures of NMe4HF2 and NMe4H2F3
SI Troyanov et al.
ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE (2005)
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy
F Weigend et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)
19F-19F spin-spin coupling constant surfaces for (HF)2 clusters:: The orientation and distance dependence of the sign and magnitude of JF-F
JE Del Bene et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
NMR studies of solid state -: solvent and H/D isotope effects on hydrogen bond geometries of 1: 1 complexes of collidine with carboxylic acids
PM Tolstoy et al.
JOURNAL OF MOLECULAR STRUCTURE (2004)
Solvent induced temperature dependencies of NMR parameters of hydrogen bonded anionic clusters
NS Golubev et al.
JOURNAL OF MOLECULAR STRUCTURE (2004)
Hydrogen bonding of water confined in mesoporous silica MCM-41 and SBA-15 studied by 1H solid-state NMR
B Grünberg et al.
CHEMISTRY-A EUROPEAN JOURNAL (2004)
Double hydrogen tunneling revisited: The breakdown of experimental tunneling criteria
CS Tautermann et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Coordination chemistry of 1,3,5-triaza-7-phosphaadamantane (PTA) - Transition metal complexes and related catalytic, medicinal and photoluminescent applications
AD Phillips et al.
COORDINATION CHEMISTRY REVIEWS (2004)
NMR parameters and geometries of OHN and ODN hydrogen bonds of pyridine-acid complexes
HH Limbach et al.
CHEMISTRY-A EUROPEAN JOURNAL (2004)
Characterization of fluxional hydrogen-bonded complexes of acetic acid and acetate by NMR: Geometries and isotope and solvent effects
PM Tolstoy et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Structures of three salts of phthalic acid; variation in crystal packing and geometry of the hydrogen phthalate ion
A Langkilde et al.
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS (2004)
Pyridine-15N -: A mobile NMR sensor for surface acidity and surface defects of mesoporous silica
IG Shenderovich et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Low-temperature NMR studies of the structure and dynamics of a novel series of acid-base complexes of HF with collidine exhibiting scalar couplings across hydrogen bonds
IG Shenderovich et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Review on DFT and ab initio calculations of scalar coupling constants
I Alkorta et al.
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES (2003)
A monomers-in-dimers model for carboxylic acid dimers
C Emmeluth et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Interpretation of hydrogen/deuterium isotope effects on NMR chemical shifts of [FHF](-) ion based on calculations of nuclear magnetic shielding tensor surface
NS Golubev et al.
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS (2003)
Computed EOM-CCSD F-19-F-19 spin-spin coupling constants in small organic molecules
JE Del Bene et al.
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS (2003)
H/D isotope effects on the low-temperature NMR parameters and hydrogen bond geometries of (FH)2F- and (FH)3F- dissolved in CDF3/CDF2Cl
IG Shenderovich et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2002)
Surface characterization of flax, hemp and cellulose fibers; Surface properties and the water uptake behavior
A Bismarck et al.
POLYMER COMPOSITES (2002)
Pseudosymmetry in pyridinium tetrachloro(oxo)pyridineniobate(V) pyridine solvate
IA Guzei et al.
ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS (2002)
Vibrational spectrum of the formic acid dimer in the OH stretch region.: A model 3D study
MV Vener et al.
CHEMICAL PHYSICS LETTERS (2001)
Influence of the temperature-dependent dielectric constant on the H/D isotope effects on the NMR chemical shifts and the hydrogen bond geometry of the collidine-HF complex in CDF3/CDClF2 solution
IG Shenderovich et al.
MAGNETIC RESONANCE IN CHEMISTRY (2001)
1H/15N NMR chemical shielding, dipolar 15N, 2H coupling and hydrogen bond geometry correlations in a novel series of hydrogen-bonded acid-base complexes of collidine with carboxylic acids
P Lorente et al.
MAGNETIC RESONANCE IN CHEMISTRY (2001)
Stray field gradient NMR reveals effects of hydrogen bonding on diffusion coefficients of pyridine in mesoporous silica
E Gedat et al.
MAGNETIC RESONANCE IN CHEMISTRY (2001)
Vibrational effects on the F-F spin-spin coupling constant (2hJF-F) in FHF- and FDF-
JE Del Bene et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2001)
Symmetry of N-H-N hydrogen bonds in 1,8-Bis(dimethylamino)naphthalene•H+ and 2,7-dimethoxy-1,8-bis(dimethylamino)naphthalene•H+
CL Perrin et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
Utilization of redox and acid/base chemistry for the deprotection of a Mn(dmpe)2(CCSiMe3)2 complex
FJ Fernández et al.
ORGANOMETALLICS (2001)
Calculation of vibrations of the H-bonds and electrooptical parameters of the [F(HF)2]- complex
VP Bulychev et al.
OPTICS AND SPECTROSCOPY (2001)
Hydrogen/deuterium-isotope effects on NMR chemical shifts and symmetry of homoconjugated hydrogen-bonded ions in polar solution
P Schah-Mohammedi et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Basicity and proton transfer in proton sponges and related compounds:: An ab initio study
I Alkorta et al.
STRUCTURAL CHEMISTRY (2000)
Theoretical methods for the description of the solvent effect in biomolecular systems
M Orozco et al.
CHEMICAL REVIEWS (2000)
NMR spin-spin coupling constants for hydrogen bonds of [F(HF)n]-, n=1-4, clusters
SA Perera et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
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