Porous aromatic frameworks (PAFs)
Y Tian, G Zhu - Chemical reviews, 2020 - ACS Publications
Porous aromatic frameworks (PAFs) represent an important category of porous solids. PAFs
possess rigid frameworks and exceptionally high surface areas, and, uniquely, they are …
possess rigid frameworks and exceptionally high surface areas, and, uniquely, they are …
Synthesis, X-ray crystal structure, vibrational spectroscopy, DFT calculations, electronic properties and Hirshfeld analysis of (E)-4-Bromo-N'-(2, 4-dihydroxy …
C Arunagiri, AG Anitha, A Subashini… - Journal of Molecular …, 2018 - Elsevier
Abstract The title compound (E)-4-Bromo-N'-(2, 4-dihydroxy-benzylidene) benzohydrazide
(4BDBH) a novel hydrazone Schiff base compound was synthesized effectively by …
(4BDBH) a novel hydrazone Schiff base compound was synthesized effectively by …
Determining the degree of methylesterification of pectin by ATR/FT-IR: Methodology optimisation and comparison with theoretical calculations
A Fellah, P Anjukandi, MR Waterland… - Carbohydrate …, 2009 - Elsevier
The application of FT-IR to the study of the structure and interactions of the major plant-cell
wall polysaccharide pectin has been reported for many decades. Nevertheless, here we …
wall polysaccharide pectin has been reported for many decades. Nevertheless, here we …
Influence of solvation on the spectral, molecular structure, and antileukemic activity of 1-benzyl-3-hydroxy-2-methylpyridin-4 (1H)-one
This research focuses on the synthesis, X-ray crystallography, spectral characterization, and
the influence of solvents on electronic molecular properties, vibrational analysis, and …
the influence of solvents on electronic molecular properties, vibrational analysis, and …
Raman spectroscopy of carbon nanohoops
We present the Raman spectra for [n] Cycloparaphenylenes ([n] CPPs) of different sizes. A
plethora of Raman modes are observed in these spectra, including modes that are …
plethora of Raman modes are observed in these spectra, including modes that are …
FTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene
S Ramalingam, S Periandy, M Govindarajan… - … Acta Part A: Molecular …, 2010 - Elsevier
In this work, the experimental and theoretical study on molecular structure and vibrational
spectra of 4-nitrotoluene are studied. The FTIR and FTRaman experimental spectra of the …
spectra of 4-nitrotoluene are studied. The FTIR and FTRaman experimental spectra of the …
Molecular spectroscopic identification of the water compartments in bone
Matrix bound water is a correlate of bone's fracture resistance and assessment of bound
water is emerging as a novel measure of bone's mechanical integrity. Raman spectroscopy …
water is emerging as a novel measure of bone's mechanical integrity. Raman spectroscopy …
Theoretical calculations and spectroscopic analysis of gaussian computational examination-NMR, FTIR, UV-Visible, MEP on 2, 4, 6-Nitrophenol
D Mamand - Journal of Physical Chemistry and Functional Materials, 2019 - dergipark.org.tr
Quantum computational is a significant method to explain and investigation the electronic
construction (ground state basically) of many-body systems, in particular atoms, molecules …
construction (ground state basically) of many-body systems, in particular atoms, molecules …
Investigation of the crystal structure, supramolecular architecture and in-silico myelofibrosis inhibition of a triazole derivative: a structural and theoretical approach
DCV Kumar, BS Chethan, D Gowda… - Journal of Molecular …, 2023 - Elsevier
One of the most significant issues in contemporary medicine and pharmacy is the search for
efficient, low-toxic anticancer medicines. In this contrast, present work involves the synthesis …
efficient, low-toxic anticancer medicines. In this contrast, present work involves the synthesis …
FT-IR and FT-Raman vibrational spectra and molecular structure investigation of nicotinamide: A combined experimental and theoretical study
S Ramalingam, S Periandy, M Govindarajan… - … Acta Part A: Molecular …, 2010 - Elsevier
In this work, the experimental and theoretical spectra of nicotinamide (C6H6N2O) are
studied. FT-IR and FT-Raman spectra of title molecule in the liquid phase have been …
studied. FT-IR and FT-Raman spectra of title molecule in the liquid phase have been …