Experimental and theoretical analysis of lp⋯ π intermolecular interactions in derivatives of 1, 2, 4-triazoles R Shukla, TP Mohan, B Vishalakshi, D Chopra CrystEngComm 16 (9), 1702-1713, 2014 | 86 | 2014 |
“Pnicogen bonds” or “chalcogen bonds”: exploiting the effect of substitution on the formation of P⋯ Se noncovalent bonds R Shukla, D Chopra Physical Chemistry Chemical Physics 18 (20), 13820-13829, 2016 | 65 | 2016 |
Crystallographic and computational investigation of intermolecular interactions involving organic fluorine with relevance to the hybridization of the carbon atom R Shukla, D Chopra CrystEngComm 17 (19), 3596-3609, 2015 | 37 | 2015 |
Yet another perspective on hole interactions N Tarannam, R Shukla, S Kozuch Physical Chemistry Chemical Physics 23 (36), 19948-19963, 2021 | 31 | 2021 |
Exploring the role of substitution on the formation of Se··· O/N noncovalent bonds R Shukla, D Chopra The Journal of Physical Chemistry B 119 (47), 14857-14870, 2015 | 28 | 2015 |
Crystallographic and Theoretical Investigation on the Nature and Characteristics of Type IC S··· S C Interactions R Shukla, D Chopra Crystal Growth & Design 16 (12), 6734-6742, 2016 | 25 | 2016 |
Characterization of the short O [double bond, length as m-dash] C⋯ O [double bond, length as m-dash] C π-hole tetrel bond in the solid state R Shukla, D Chopra CrystEngComm 20 (24), 3308-3312, 2018 | 24 | 2018 |
Complex electronic interplay of σ-hole and π-hole interactions in crystals of halogen substituted 1, 3, 4-oxadiazol-2 (3 H)-thiones R Shukla, I Khan, A Ibrar, J Simpson, D Chopra CrystEngComm 19 (25), 3485-3498, 2017 | 22 | 2017 |
Characterization of N⋯ O non-covalent interactions involving σ-holes:“electrostatics” or “dispersion” R Shukla, D Chopra Physical Chemistry Chemical Physics 18 (43), 29946-29954, 2016 | 21 | 2016 |
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 R Shukla, N Claiser, M Souhassou, C Lecomte, SJ Balkrishna, S Kumar, ... IUCrJ 5 (5), 647-653, 2018 | 19 | 2018 |
Chalcogen and pnictogen bonds: insights and relevance R Shukla, D Chopra | 17 | 2021 |
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 … A Mandal, BK Patel, R Shukla, D Chopra CrystEngComm 19 (12), 1607-1619, 2017 | 15 | 2017 |
Synthesis, crystal structure and theoretical analysis of intermolecular interactions in two biologically active derivatives of 1, 2, 4-triazoles R Shukla, TP Mohan, B Vishalakshi, D Chopra Journal of Molecular Structure 1134, 426-434, 2017 | 14 | 2017 |
Understanding the effect of substitution on the formation of S... F chalcogen bond R Shukla, D Chopra Journal of Chemical Sciences 128, 1589-1596, 2016 | 14 | 2016 |
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 PK Mondal, R Shukla, S Biswas, D Chopra Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2018 | 12 | 2018 |
Quantitative investigation of C–H⋯ π and other intermolecular interactions in a series of crystalline N-(substituted phenyl)-2-naphthamide derivatives R Shukla, A Saeed, J Simpson, D Chopra CrystEngComm 19 (36), 5473-5491, 2017 | 12 | 2017 |
Understanding Reactivity and Assembly of Dichalcogenides: Structural, Electrostatic Potential, and Topological Analyses of 3H-1,2-Benzodithiol-3-one and … R Shukla, A Dhaka, E Aubert, V Vijayakumar-Syamala, O Jeannin, ... Crystal Growth & Design 20 (12), 7704-7725, 2020 | 11 | 2020 |
Effect of chemical substitution on the construction of boroxine-based supramolecular crystalline polymers featuring B← N dative bonds S Bhandary, R Shukla, K Van Hecke CrystEngComm 24 (9), 1695-1699, 2022 | 10 | 2022 |
Characterization of non-classical CBr⋯ π interactions in (E)-1, 3-dibromo-5-(2-(ferrocenyl) vinyl) benzene and related derivatives of ferrocene R Shukla, P Panini, CJ McAdam, BH Robinson, J Simpson, T Tagg, ... Journal of Molecular Structure 1131, 16-24, 2017 | 10 | 2017 |
Insight from electron density and energy framework analysis on the structural features of Fx-TCNQ (x= 0, 2, 4) family of molecules R Shukla, C Ruzié, G Schweicher, AR Kennedy, YH Geerts, D Chopra, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2019 | 9 | 2019 |