Synthesis and charaterizations of the Schiff base derived from 2-hydroxy-5-nitrobenzaldehyde alongwith Hirshfeld surface analysis and computational study
The current research work is about the synthesis of the novel Schiff base obtained by the
condensation reaction of 2-hydroxy-5-nıtrobenzaldehyde with 3-fluoroaniline. The …
condensation reaction of 2-hydroxy-5-nıtrobenzaldehyde with 3-fluoroaniline. The …
Persistent prevalence of non-covalent interaction in pyrimidine containing sulfonamide derivative: A quantum computational analysis
A novel pyrimidine containing sulfonamide derivative has been synthesized and
characterized by spectroscopic techniques like FT-IR, NMR and Mass. Single crystal X-ray …
characterized by spectroscopic techniques like FT-IR, NMR and Mass. Single crystal X-ray …
Synthesis, crystal structure, DFT, Hirshfeld surface analysis, energy frameworks and in-Silico drug-targeting PFKFB3 kinase of novel triazolequinoxalin derivative (TZQ …
Overall, drug design is a dynamic and evolving field, with researchers constantly working to
improve their understanding of molecular interactions, develop new computational methods …
improve their understanding of molecular interactions, develop new computational methods …
Single-crystal XRD, Hirshfeld surfaces, 3D energy framework calculations, and DFT studies of 4, 5-diphenyl-1, 3, 4-thiadiazole-2-thiolate: A mesoionic compound
T Vishwanath, A Ashish, CKR Shankar… - Journal of Molecular …, 2022 - Elsevier
The single crystal of mesoionic 4, 5-diphenyl-1, 3, 4-thiadiazolium-2-thiolate 2 was obtained
by the solvent evaporation method. The compound was characterized by spectroscopic and …
by the solvent evaporation method. The compound was characterized by spectroscopic and …
Green and chemical approach for synthesis of Ag2O nanoparticles and their antimicrobial activity
H Patel, J Joshi - Journal of Sol-Gel Science and Technology, 2023 - Springer
Green synthesis of nanomaterials is a current topic of extensive research and a number of
green approaches as microorganisms and plant extracts have been explored as an …
green approaches as microorganisms and plant extracts have been explored as an …
Palladium (II) complexes bearing N, O-bidentate Schiff base ligands: Experimental, in-silico, antibacterial, and catalytic properties
Two N, O-bidentate ligands (1, 2), and their Pd (II) complexes,(1a, 2a) were synthesized and
characterized via elemental analysis, IR, 1 H and 13 C NMR, magnetic moment and UV …
characterized via elemental analysis, IR, 1 H and 13 C NMR, magnetic moment and UV …
Single crystal investigation, Hirshfeld surface and interaction energy framework analyses of structure-directing interactions within two isomorphous Schiff's base …
The two new isomorphous Schiff's base multicomponent salts, 1 and 2, have been
synthesized using solvent assisted grinding (SAG) methodology and are characterized …
synthesized using solvent assisted grinding (SAG) methodology and are characterized …
Probing the hydrogen bond network in the crystal structure of a sulfonamide derivative: A quantum chemical approach
A novel sulfonamide derivative, N-[2-[(5-bromo-2-chloro-4-pyrimidinyl) thio]-4-
methoxyphenyl] benzene sulfonamide, was synthesized and characterized using …
methoxyphenyl] benzene sulfonamide, was synthesized and characterized using …
Crystallographic, antibacterial, and in silico studies of Ni (II) and Cu (II) Schiff base complexes derived from 2-acetylpyridine
Two Schiff base complexes, namely Ni (L1)(NCS) 2 (2) and Cu (L1)(NCS). SCN (3)(where
L1=[N, N′-bis (1-(pyridin-2-yl) ethylidene) propane-1, 3-diamine]) have been synthesized …
L1=[N, N′-bis (1-(pyridin-2-yl) ethylidene) propane-1, 3-diamine]) have been synthesized …
[HTML][HTML] Single crystal XRD and DFT investigation of 1, 5-dimethyl-4-[(2-oxo-1, 2-diphenylethylidene) amino]-2-phenyl-1, 2-dihydro-3H-pyrazol-3-one
SA Raj, VG Vidya, V Preethi, VGV Kumar - Results in Chemistry, 2022 - Elsevier
Abstract The single crystal 1, 5-dimethyl-4-[(2-oxo-1, 2-diphenylethylidene) amine]-2-phenyl-
1, 2-dihydro-3H-pyrazol-3-one [DDAPDP] was designed to enhance luminescence property …
1, 2-dihydro-3H-pyrazol-3-one [DDAPDP] was designed to enhance luminescence property …