Halogen acceptors in hydrogen bonding

A Kovács, Z Varga - Coordination chemistry reviews, 2006 - Elsevier
This review provides a comparative assessment of hydrogen bonding (HB) interactions with
halogen (X) acceptors. Based on the data available in the literature we selected various inter …

Cooperative effects in hydrogen bonding

A Karpfen - Advances in chemical physics, 2002 - Wiley Online Library
The aim of this chapter is to survey recent quantum chemical calculations that attempt to
track and to monitor the gradual differences between isolated hydrogen bonds, hydrogen …

Structure, energetics and vibrational spectra of dimers, trimers, and tetramers of HX (X= Cl, Br, I)

Z Latajka, S Scheiner - Chemical physics, 1997 - Elsevier
The title complexes are studied by correlated ab initio methods using a pseudopotential
double-ζ basis set, augmented by diffuse sp and two sets of polarization functions. The …

Infrared Spectrum of the H3N−HCl Complex in Solid Ne, Ne/Ar, Ar, and Kr. Matrix Effects on a Strong Hydrogen-Bonded Complex

L Andrews, X Wang, Z Mielke - The Journal of Physical Chemistry …, 2001 - ACS Publications
Ammonia and hydrogen chloride vapors from thermal decomposition of NH4Cl co-deposited
with excess neon at 4− 5 K formed the H3N− HCl complex. Strong, broad 2084 cm-1 and …

Binding energy, structure, and vibrational spectra of and clusters by density functional theory

RC Guedes, PC Do Couto… - The Journal of chemical …, 2003 - pubs.aip.org
We are reporting density functional theory results for the binding energies, structures, and
vibrational spectra of (H-Cl) 2–6 and (HF) 2–10 clusters. The performance of different …

High-resolution IR studies of hydrogen bonded clusters: Large amplitude dynamics in (HCl) n

M Fárník, S Davis, DJ Nesbitt - Faraday Discussions, 2001 - pubs.rsc.org
Structural and dynamical information on small hydrogen-bonded systems is revealed by
high-resolution IR spectroscopy of HCl dimer, trimer and tetramer. In (HCl) 2, four …

Infrared photoisomerization of the methanol cyclic trimer trapped in a nitrogen matrix

S Coussan, N Bakkas, A Loutellier, JP Perchard… - Chemical physics …, 1994 - Elsevier
Condensation of nitrogen/methanol mixtures at 15 K revealed broad 3450 and 3284 cm− 1
absorptions assignable to (CH 3 OH) n aggregates, n⩾ 3. The 3450 cm− 1 band is infrared …

Infrared Spectrum of the H3N−HCl Complex in Solid Neon

L Andrews, X Wang, Z Mielke - Journal of the American Chemical …, 2001 - ACS Publications
Hydrogen bonding, the most wide-spread of intermolecular interactions, is responsible for
the unique properties of water and molecular organization in living systems. The “hydrogen …

Investigation of the ground vibrational state structure of H35Cl trimer based on the resolved K, J substructure of the ν5 vibrational band

J Han, Z Wang, AL McIntosh, RR Lucchese… - The Journal of chemical …, 1994 - pubs.aip.org
D~= 4.32 (22) XlO-7 cm-r, D~= 4.16 (22) XlO-7 cm-I. A relationship among the centrifugal
distortion constants establishes that the geometry of (H35Clh is consistent with a …

Intramolecular energy transfer between oriented chromophores: High-resolution infrared spectroscopy of HCl trimer

M Fárnı́k, DJ Nesbitt - The Journal of chemical physics, 2004 - pubs.aip.org
Detailed dynamical and structural information has been obtained for hydrogen-bonded
(HCl) 3 clusters via high-resolution IR laser absorption spectroscopy in a supersonic slit …