Towards clarifying the N-M vibrational nature of metallo-phthalocyanines: Infrared spectrum of phthalocyanine magnesium complex: Density functional calculations

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 60, Issue 10, 2004, Pages 2195-2200

  Zhang, Xianxi ^a   Zhang, Yuexing ^a   Jiang, Jianzhuang ^a  

^a SHANDONG UNIVERSITY   (China)

Author keywords

DFT method; IR spectra; Phthalocyanine

Indexed keywords

COMPLEXATION; COMPUTATIONAL METHODS; COMPUTER SIMULATION; MAGNESIUM COMPOUNDS; MOLECULAR VIBRATIONS; NITROGEN COMPOUNDS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; RAMAN SCATTERING;

DENSITY FUNCTIONAL THEORY (DFT); IN-PLANE BENDING (IPB); IR SPECTRA; PHTHALOCYANINE;

INFRARED SPECTROSCOPY;

INDOLE DERIVATIVE; MAGNESIUM; PHTHALOCYANINE;

ARTICLE; CHEMISTRY; INFRARED SPECTROPHOTOMETRY; STATISTICAL ANALYSIS;

CHEMISTRY, ANALYTICAL; DATA INTERPRETATION, STATISTICAL; INDOLES; MAGNESIUM; SPECTROPHOTOMETRY, INFRARED;

EID: 3042713496     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2003.11.015     Document Type: Article

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