Published 2016 | Version v1
Journal article Metadata-only

Quantum-chemical calculation of structure and vibration spectrum of heteronuclear glycin μ3-oxo cluster [Fe+32Ni+2O(NH2CH2COO)6(H2O3)]

Creators

  • 1. Andijan State University, Andijan(Uzbekistan)
  • 2. V.I. Nikitin Institute of Chemistry, Academy of Sciences of the Republic of Tajikistan, Dushanbe (Tajikistan)

Description

Quantum-chemical calculations of structure and vibrational spectrum of μ3-oxo glycinate complex performed using the Gaussian 98 software package showed their agreement with experimental data. The symmetry of molecule of studied μ3-oxo cluster is much lower than C2v. A decrease in the symmetry of molecule leads to a splitting of characteristic vibrational frequencies in the spectra into many component lines. (author)

Availability note (English)

Available from http://elibrary.ru/

Additional details

Additional titles

Original title (Russian)
Квантово-химическиы расчет структуры и колебател&апос;ного спектра гетероядерного глицинового μ<суб>3</суб>-оксокластера [Фе<суп>+3</суп><суб>2</суб>Ни<суп>+2</суп>О(NH<суб>2</суб>CH<суб>2</суб>COO)<суб>6</суб>(Х<суб>2</суб>О<суб>3</суб>)]

Identifiers

URL
http://elibrary.ru/;

Publishing Information

Journal Title
Vestnik Natsionalnogo Universiteta
Journal Volume
1-4
Journal Issue
216
Journal Page Range
p. 80-88
ISSN
1993-6923

INIS

Country of Publication
Tajikistan
Country of Input or Organization
Tajikistan
INIS RN
52040474
Subject category
S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
Descriptors DEI
FREQUENCY RANGE; HYBRIDIZATION; MECHANICAL VIBRATIONS; MOLECULAR STRUCTURE; SPECTROSCOPY; SYMMETRY