Molecularly imprinted organic solvent nanofiltration membranes–Revealing molecular recognition and solute rejection behaviour

G Székely, IB Valtcheva, JF Kim… - Reactive and Functional …, 2015 - Elsevier
A new class of organic solvent nanofiltration (OSN) membranes featuring molecular
recognition sites has been fabricated by a phase inversion molecular imprinting technique …

FT-IR, FT-Raman and DFT quantum chemical study on the molecular conformation, vibrational and electronic transitions of 1-(m-(trifluoromethyl) phenyl) piperazine

N Prabavathi, A Nilufer, V Krishnakumar - Spectrochimica Acta Part A …, 2014 - Elsevier
Abstract The FTIR and FT-Raman spectra of 1-(m-(trifluoromethyl) phenyl) piperazine
[TFMPP] have been recorded in the region 4000–400 cm− 1 and 3500–100 cm− 1 …

Theoretical study of the structure and properties of Ni/V porphyrins under microwave electric field: A DFT study

Y Li, H Shang, Q Zhang, M Elabyouki, W Zhang - Fuel, 2020 - Elsevier
Petroporphyrins with nickel (Ni) and vanadium (V) metals in crude oil are harmful to the
catalysts of fluid catalytic cracking (FCC) and residue hydrocracking (RHC) as well as their …

Terahertz spectra of DNA nucleobase crystals: A joint experimental and computational study

F Wang, D Zhao, H Dong, L Jiang, Y Liu, S Li - Spectrochimica Acta Part A …, 2017 - Elsevier
Terahertz (THz) spectra of DNA nucleobase crystals were experimentally studied by
terahertz time domain spectroscopy (THz-TDS), Fourier transform infrared spectroscopy …

Structural, spectral, optical and antimicrobial properties of synthesized 1-benzoyl-3-furan-2-ylmethyl-thiourea

F Karipcin, M Atis, B Sariboga, H Celik, M Tas - Journal of Molecular …, 2013 - Elsevier
Abstract The 1-benzoyl-3-furan-2-ylmethyl-thiourea (bftu) was synthesized and its structure
was determined by elemental analyses, IR spectroscopy, 1 H and 13 C NMR spectroscopy …

Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation, conformational stability, NLO properties, HOMO–LUMO and NBO analysis of hydroxyquinoline …

N Prabavathi, A Nilufer, V Krishnakumar - Spectrochimica Acta Part A …, 2013 - Elsevier
Abstract The FTIR and FT-Raman spectra of 2-hydroxyquinoline and its derivatives have
been recorded in the region 4000–400 cm− 1 and 3500–100 cm− 1, respectively. The …

Molecular structure, spectroscopic and quantum chemical studies on benzoic acid and succinic acid co-crystals of 2-aminopyrimidine

S Thangarasu, V Siva, S Athimoolam… - Journal of Theoretical …, 2018 - World Scientific
Organic nonlinear optical co-crystals 2-aminopyrimidine benzoic acid (2APB) and 2-
aminopyrimidine succinic acid (2APS) have been successfully grown by slow solvent …

Vibrational spectroscopic (FT-IR and FT-Raman) studies, natural bond orbital analysis and molecular electrostatic potential surface of Isoxanthopterin

N Prabavathi, A Nilufer, V Krishnakumar - Spectrochimica Acta Part A …, 2013 - Elsevier
Abstract The FTIR and FT-Raman spectra of Isoxanthopterin have been recorded in the
region 4000–450 and 4000–100 cm− 1, respectively. The optimized geometry, frequency …

Experimental and theoretical study of surface-enhanced Raman spectra of sulfadiazine adsorbed on nanoscale gold colloids

XR Shen, H Zheng, R Pang, GK Liu… - The Journal of …, 2019 - ACS Publications
Sulfadiazine, as a class of antibiotics, has been widely used in the world for decades;
however, its surface-enhanced Raman spectra (SERS) on gold colloids are obviously …

[PDF][PDF] Reviewing of synthesis and computational studies of pyrazolo pyrimidine derivatives

HSH Mohamed, SA Ahmed - J chem rev, 2019 - researchgate.net
Heterocyclic pyrimidine nucleus includes four carbon and two nitrogen atoms and is
pharmacologically in active; however, its synthetic derivatives have important roles in …