The n→π* interaction is an extremely weak but very important noncovalent interaction. Although this interaction is widely present in biomolecules and materials, its existence is counterintuitive and so has been debated extensively. Herein, we have reported direct spectroscopic evidence for an n→π* interaction for the first time by probing the carbonyl stretching frequency in phenyl formate using isolated gas-phase IR spectroscopy. This result also demonstrates that the conformational preference for the cis conformer of phenyl formate compared to the trans conformer arises due to the presence of the n→π* interaction in the former. The direct proof reported herein for this controversial but important noncovalent interaction should stimulate further experimental and theoretical investigation on this intriguing research topic.
A new room‐temperature electrodeposition technique was devised to synthesize
normalSnS
thin films on indium tin oxidecoated glass slides. This technique is based on a nonaqueous ethylene glycol bath containing anhydrous
SnCl2
and elemental sulfur. Three types of electrosyntheses, namely, potentiostatic, galvanostatic, and pulse modes, are discussed and their relative merits compared. A wide variety of characterization techniques were employed to develop a self‐consistent and complementary picture of the morphology, composition, and photoactivity of the
normalSnS
thin films. These included scanning electron microscopy, x‐ray diffractometry, electron probe microanalyses, Auger electron spectroscopy, x‐ray photoelectron spectroscopy, optical analyses, and voltammetry. The photoactivity of these films was evaluated using photoelectrochemical techniques. Finally, the dark and photocorrosion behavior of these films are discussed with the aid of Pourbaix diagrams.
Subsequent to the recent re-definition of hydrogen bonding by the IUPAC committee, there has been a growing search for finding the presence of this ever interesting non-covalent interaction between a hydrogen atom in an X-H group and any other atom in the periodic table. In recent gas phase experiments, it has been observed that hydrogen bonding interactions involving S and Se are of similar strength to those with an O atom. However, there is no clear explanation for the unusual strength of this interaction in the case of hydrogen bond acceptors which are not conventional electronegative atoms. In this work, we have explored the nature of Se hydrogen bonding by studying indoledimethyl selenide (indmse) and phenoldimethyl selenide (phdmse) complexes using gas phase IR spectroscopy and quantum chemistry calculations. We have found through various energy decomposition analysis (EDA) methods and natural bond orbital (NBO) calculations that, along with electrostatics and polarization, charge transfer interactions are important to understand Se/S hydrogen bonding and there is a delicate balance between the various interactions that plays the crucial role rather than a single component of the interaction energy. An in-depth understanding of this type of non-covalent interaction has immense significance in biology as amino acids containing S and Se are widely present in proteins and hence hydrogen bonding interactions involving S and Se atoms contribute to the folding of proteins.
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