Komal Yadav

ORCID: 0000-0002-7357-1109
Publications
Citations
Views
---
Saved
---
About
Contact & Profiles
Research Areas
  • Catalytic C–H Functionalization Methods
  • Radical Photochemical Reactions
  • Catalytic Alkyne Reactions
  • Catalytic Cross-Coupling Reactions
  • Spectroscopy and Quantum Chemical Studies
  • Sulfur-Based Synthesis Techniques
  • X-ray Diffraction in Crystallography
  • History and advancements in chemistry
  • Molecular spectroscopy and chirality
  • Synthesis and Properties of Aromatic Compounds
  • Supramolecular Chemistry and Complexes
  • Luminescence and Fluorescent Materials
  • Molecular Junctions and Nanostructures
  • Organometallic Complex Synthesis and Catalysis
  • Synthesis and characterization of novel inorganic/organometallic compounds
  • Cyclopropane Reaction Mechanisms
  • Advanced Chemical Physics Studies
  • Organoboron and organosilicon chemistry
  • Crystallization and Solubility Studies
  • Molecular Spectroscopy and Structure

University of Hawaiʻi at Mānoa
2024

University of Hawaii System
2024

National Institute of Science Education and Research
2020-2022

Homi Bhabha National Institute
2022

1,4-cis-Disubstituted cyclic compounds play a pivotal role in pharmaceutical development, offering enhanced potency and bioavailability. However, their stereoselective modular synthesis remains long-standing challenge. Here, we report an innovative strategy for accessing these structures via mild conditions employing 1,3-dienes/alkyl(aryl)halides amines. This procedure exhibits wide substrate scope that tolerates various functional groups. The utility of this method is demonstrated the...

10.1021/acscentsci.4c00094 article EN cc-by ACS Central Science 2024-05-15

Palladium-catalyzed tandem activation and functionalization of readily accessible cyclopropanols have been demonstrated to access valuable conjugated enynes from 1,3-diynes with high stereo-selectivity.

10.1039/d1sc04780a article EN cc-by-nc Chemical Science 2022-01-01

Herein, nickel-catalyzed synthesis of polyarylcarbazole through sequential C-H bond activations has been described. Regioselective indole C2/C3 functionalization achieved in the presence C7-H, which is quite challenging. In addition, this approach also gives easy access to building a heteropolycyclic motif C6/C7 indoline. This methodology not limited aromatic internal alkynes as coupling partners; aliphatic have shown good tolerance. Notably, during optimization catalytic enhancement with...

10.1021/acs.orglett.1c03234 article EN Organic Letters 2021-11-17

First examples of racemization tetrahedral tetracoordinated centers <italic>via</italic> a planar transition state or an intermediate structure.

10.1039/d0cp02918a article EN Physical Chemistry Chemical Physics 2020-01-01

The transition state, a first-order saddle point on the potential energy surface, plays central role in understanding mechanism, dynamics, and rate of chemical reactions. However, we recently identified energetically accessible second-order saddles (SOS) certain reactions showed that SOS crucial dynamics [Pradhan et al., Phys. Chem. Phys., 2019, 21, 12837; Rashmi Regul. Chaotic Dyn., 2021, 26, 119]. In present work, investigated points thermal denitrogenation 1-pyrazoline using ab initio...

10.1039/d2fd00026a article EN Faraday Discussions 2022-01-01

1,4-cis-disubstituted cyclic compounds play a pivotal role in pharmaceutical development, offering enhanced potency and bioavailability. However, their stereoselective modular synthesis remains long-standing challenge. Here, we report an innovative strategy for accessing these structures via mild conditions employing 1,3-dienes/alkyl(aryl)halides amines. This procedure exhibits wide substrate scope that tolerates various functional groups. The utility of this method is demonstrated the...

10.26434/chemrxiv-2024-v3dsv preprint EN cc-by-nc-nd 2024-02-19

The quest for stabilizing planar forms of tetracoordinate carbon started five decades ago and intends to achieve interconversion between [R]- [S]-stereoisomers without breaking covalent bonds. Several strategies are successful in making the form a minimum on its potential energy surface. However, first examples systems where stereomutation is possible were reported only recently. In this study, possibility neutral dications simple hydrocarbons (cyclopentane, cyclopentene, spiropentane,...

10.3390/atoms9040079 article EN cc-by Atoms 2021-10-14

We report here the first example of use 1,3-dialkynes in C-C bond activation with any metal. The regio- and stereo-selective synthesis 1,3-enynes from 1,3-diynes is demonstrated by palladium-catalyzed cyclo-propanol. Exclusive formation mono-alkenylated adduct was achieved eliminating possibility di-functionalization high stereo-selectivity. Indeed, this protocol worked very well electronically sterically diverse substrates. Several studies, including deuterium labeling experiments...

10.33774/chemrxiv-2021-grm27 preprint EN cc-by-nc-nd 2021-08-25

We report here the first example of use 1,3-dialkynes in C-C bond activation with any metal. The regio- and stereo-selective synthesis 1,3-enynes from 1,3-diynes is demonstrated by palladium-catalyzed cyclo-propanol. Exclusive formation mono-alkenylated adduct was achieved eliminating possibility di-functionalization high stereo-selectivity. Indeed, this protocol worked very well electronically sterically diverse substrates. Several studies, including deuterium labeling experiments...

10.26434/chemrxiv-2021-grm27 preprint EN cc-by-nc-nd 2021-08-25
Coming Soon ...