𝔖 Bobbio Scriptorium
✦   LIBER   ✦

NQR and NMR study of hydrogen bonding interactions in anhydrous and monohydrated guanine cluster model: A computational study

✍ Scribed by M. Monajjemi; B. Honarparvar; S. M. Nasseri; M. Khaleghian


Book ID
106427707
Publisher
SP MAIK Nauka/Interperiodica
Year
2009
Tongue
English
Weight
199 KB
Volume
50
Category
Article
ISSN
0022-4766

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Characterization of intermolecular inter
✍ Mehdi D. Esrafili; Vahideh Alizadeh 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 177 KB

## Abstract A computational study at the level of density functional theory was carried out to characterize the ^17^O and ^2^H nuclear quadrupole resonance (NQR) spectroscopy parameters in crystalline aspirin. To include OH···O and CH···O hydrogen bonding effects in the calculations, the most pro

17O NMR spectroscopy: Study of intramole
✍ David W. Boykin; S. Chandrasekaran; A. L. Baumstark 📂 Article 📅 1993 🏛 John Wiley and Sons 🌐 English ⚖ 480 KB

## Abstract Natural abundance ^17^O NMR data for fifteen 2‐ and 4‐substituted phenols, ten 3‐and 5‐substituted 2‐hydroxybenzaldehydes and eight 3‐substituted benzaldehydes, recorded at 75°C in acetonitrile are reported. The chemical shift change due to intramolecular hydrogen bonding for the phenol

Hydrogen bonding in complexes of adenosi
✍ Eline M. Basilio Janke; Anita Dunger; Hans-Heinrich Limbach; Klaus Weisz 📂 Article 📅 2001 🏛 John Wiley and Sons 🌐 English ⚖ 142 KB

NMR experiments were performed on the association of the two sugar-protected nucleosides 2 -deoxy-4-thiouridine and 2 -deoxyadenosine in solution. Using an aprotic CDClF 2 -CDF 3 solvent mixture, low-temperature measurements allowed the observation of individual hydrogen-bonded complexes in the slow

Interstitial water and the formation of
✍ Ka-Un Lao; Timm Lankau; Teng-I Fang; Jian-Wei Zou; Chin-Hui Yu 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 577 KB

## Abstract The B3LYP/D95+(d,p) analysis of the uncharged low barrier hydrogen bond (LBHB) between 4‐methyl‐1__H__‐imidazole (Mim) and acetic acid (HAc) shows that uncharged LBHBs can be formed either by adding three water molecules around the cluster or by placing the Mim–HAc pair in a dielectric