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Rahul Shukla

Experimental and theoretical analysis of lp⋯π intermolecular interactions in derivatives of 1,2,4-triazoles
2013 · Rahul Shukla, T. P. Mohan, et al. · CrystEngComm · 89
Yet another perspective on hole interactions
2021 · Naziha Tarannam, Rahul Shukla, et al. · Physical Chemistry Chemical Physics · 70
Single-Crystal-to-Single-Crystal Photosynthesis of Supramolecular Organoboron Polymers with Dynamic Effects
2024 · Subhrajyoti Bhandary, Marek Beliš, et al. · Journal of the American Chemical Society · 64
“Pnicogen bonds” or “chalcogen bonds”: exploiting the effect of substitution on the formation of P⋯Se noncovalent bonds
2016 · Rahul Shukla, Deepak Chopra · Physical Chemistry Chemical Physics · 60
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Crystallographic and computational investigation of intermolecular interactions involving organic fluorine with relevance to the hybridization of the carbon atom
2015 · Rahul Shukla, Deepak Chopra · CrystEngComm · 41
Chalcogen and Pnictogen Bonds: Insights and Relevance
2021 · Rahul Shukla, Deepak Chopra · Current Science · 39
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Exploring the simultaneous σ-hole/π-hole bonding characteristics of a Br...π interaction in an ebselen derivative via experimental and theoretical electron-density analysis
2018 · Rahul Shukla, Nicolas Claiser, et al. · IUCrJ · 27
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Characterization of the short OC⋯OC π-hole tetrel bond in the solid state
2018 · Rahul Shukla, Deepak Chopra · CrystEngComm · 27
Exploring the Role of Substitution on the Formation of Se···O/N Noncovalent Bonds
2015 · Rahul Shukla, Deepak Chopra · The Journal of Physical Chemistry B · 27
Crystallographic and Theoretical Investigation on the Nature and Characteristics of Type I C═S···S═C Interactions
2016 · Rahul Shukla, Deepak Chopra · Crystal Growth & Design · 26
Complex electronic interplay of σ-hole and π-hole interactions in crystals of halogen substituted 1,3,4-oxadiazol-2(3H)-thiones
2017 · Rahul Shukla, Imtiaz Khan, et al. · CrystEngComm · 23
Understanding Reactivity and Assembly of Dichalcogenides: Structural, Electrostatic Potential, and Topological Analyses of 3H-1,2-Benzodithiol-3-one and Selenium Analogs
2020 · Rahul Shukla, Arun Dhaka, et al. · Crystal Growth & Design · 19
Effect of chemical substitution on the construction of boroxine-based supramolecular crystalline polymers featuring B←N dative bonds
2022 · Subhrajyoti Bhandary, Rahul Shukla, et al. · CrystEngComm · 18
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Synthesis, crystal structure and theoretical analysis of intermolecular interactions in two biologically active derivatives of 1,2,4-triazoles
2017 · Rahul Shukla, T.P. Mohan, et al. · Journal of Molecular Structure · 18
Characterization of N⋯O non-covalent interactions involving σ-holes: “electrostatics” or “dispersion”
2016 · Rahul Shukla, Deepak Chopra · Physical Chemistry Chemical Physics · 18
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Yet another perspective on hole interactions, part II: lp-hole vs. lp-hole interactions
2023 · Rahul Shukla, Dongkun Yu, et al. · Physical Chemistry Chemical Physics · 17
Photomechanical B←N Molecular Crystals: From Single-Crystal-to-Single-Crystal [2 + 2] Photodimerization to Polymerization
2025 · Subhrajyoti Bhandary, Rahul Shukla, et al. · Accounts of Chemical Research · 16
Role of halogen-involved intermolecular interactions and existence of isostructurality in the crystal packing of —CF3 and halogen (Cl or Br or I) substituted benzamides
2018 · Pradip Kumar Mondal, Rahul Shukla, et al. · Acta Crystallographica Section B Structural Science Crystal Engineering and Materials · 16
Understanding the effect of substitution on the formation of S. . .F chalcogen bond
2016 · RAHUL SHUKLA, DEEPAK CHOPRA · Journal of Chemical Sciences · 14
Impact of the complementary electronic nature of C–X and M–X halogens and intramolecular X⋯O interaction on supramolecular assemblies of Zn( ii ) complexes of o-halophenyl substituted hydrazides
2017 · Arkalekha Mandal, Bhisma K. Patel, et al. · CrystEngComm · 13
Quantitative investigation of C–H⋯π and other intermolecular interactions in a series of crystalline N-(substituted phenyl)-2-naphthamide derivatives
2017 · Rahul Shukla, Aamer Saeed, et al. · CrystEngComm · 13
Characterization of non-classical C Br⋯π interactions in (E)-1,3-dibromo-5-(2-(ferrocenyl)vinyl)benzene and related derivatives of ferrocene
2016 · Rahul Shukla, Piyush Panini, et al. · Journal of Molecular Structure · 9
Quantitative investigation on the intermolecular interactions present in 8-(4-ethoxyphenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione with insight from interaction energies, energy framework, electrostatic potential map and fingerprint analysis
2020 · Rahul Shukla, Prabal Bandopadhyay, et al. · Journal of Chemical Sciences · 6
Analysis of intermolecular interactions in 3-(4-fluoro-3-phenoxyphenyl)-1-((4-methylpiperazin-1-yl)methyl)-1H-1,2,4-triazole-5-thiol
2014 · PIYUSH PANINI, RAHUL SHUKLA, et al. · Journal of Chemical Sciences · 5
Quantitative evaluation of the electronic features involving “nucleophilic–electrophilic” character in the chalcogen sulfur
2023 · Koushik Mandal, Avantika Hasija, et al. · Physical Chemistry Chemical Physics · 4
Works count: 98
Citation count: 711
H-index: 16
I10-index: 21
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