1.

Record Nr.

UNINA9910770270803321

Autore

Vogt Natalja

Titolo

Equilibrium Structure of Free Molecules [[electronic resource] ] : Theory, Experiment, and Data Analysis / / by Natalja Vogt, Jean Demaison

Pubbl/distr/stampa

Cham : , : Springer International Publishing : , : Imprint : Springer, , 2023

ISBN

3-031-36045-1

Edizione

[1st ed. 2023.]

Descrizione fisica

1 online resource (482 pages)

Collana

Lecture Notes in Chemistry, , 2192-6603 ; ; 111

Altri autori (Persone)

DemaisonJean

Disciplina

541.22

Soggetti

Quantum chemistry

Atomic structure 

Molecular structure

Molecular spectroscopy

Electrons - Diffraction

Instrumental analysis

Spectrum analysis

Quantum Chemistry

Atomic and Molecular Structure and Properties

Molecular Spectroscopy

Diffraction

Spectroscopy

Lingua di pubblicazione

Inglese

Formato

Materiale a stampa

Livello bibliografico

Monografia

Nota di contenuto

Introduction -- Quantum Chemical Methods -- Rovibrational Spectroscopy and Structure of Diatomic Molecules -- Rotational Constants of a Polyatomic Molecule -- Equilibrium Structures of Semirigid Molecules from the Rotational Constants -- Structure of Nonrigid Molecules by Spectroscopic Methods -- Equilibrium Molecular Structure as Determined by Gas-phase Electron Diffraction -- Other Methods, Mainly for the X–H bond (X = C, N, O) -- Database with Equilibrium Structures of Free Molecules.

Sommario/riassunto

The properties of chemical, pharmaceutical, and biological compounds depend mainly on their molecular structure, whose determination is of



fundamental interest. This book examines and systematizes more than three hundred striking structural determinations of free molecules. Featuring high-quality structural data and presenting modern techniques of their determinations by quantum chemistry, high-resolution spectroscopy and electron diffraction, the book is an indispensable resource for graduate students and professional scientists specializing in structural chemistry and other related fields.