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Kannan, Ramkumar and Chambenahalli, Raju and Kumar, Sandeep and Krishna, Athul and Andrews, Alex P and Jemmis, Eluvathingal D and Venugopal, Ajay (2019) Organoaluminum cations for carbonyl activation. In: CHEMICAL COMMUNICATIONS, 55 (97). pp. 14629-14632.
Joy, Jyothish and Jemmis, Eluvathingal D (2019) Designing M-bond (X-M center dot center dot center dot Y, M = transition metal): sigma-hole and radial density distribution. In: JOURNAL OF CHEMICAL SCIENCES, 131 (12, SI).
Saha, Koushik and Ghorai, Sagar and Kar, Sourav and Saha, Suvam and Halder, Rajarshi and Raghavendra, Dr Beesam and Jemmis, Eluvathingal D and Ghosh, Sundargopal (2019) Stabilization of Classical B2H5](-): Structure and Bonding of (Cp*Ta)(2)(B2H5)(mu-H)L-2] (Cp*=eta(5)-C5Me5; L=SCH2S). In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION .
Sarkar, Samir Kumar and Siddiqui, Mujahuddin M and Kundu, Subrata and Ghosh, Munmun and Kretsch, Johannes and Stollberg, Peter and Herbst-Irmer, Regine and Stalke, Dietmar and Stueckl, A Claudia and Schwederski, Brigitte and Kaim, Wolfgang and Ghorai, Sagar and Jemmis, Eluvathingal D and Roesky, Herbert W (2019) Isolation of base stabilized fluoroborylene and its radical cation. In: DALTON TRANSACTIONS, 48 (24). pp. 8551-8555.
Machacek, Jan and Frances-Monerris, Antonio and Karmodak, Naiwrit and Roca-Sanjuan, Daniel and Fanfrlik, Jindrich and Londesborough, Michael G S and Hnyk, Drahommir and Jemmis, Eluvathingal D (2019) A theoretical analysis of the structure and properties of B26H30 isomers. Consequences to the laser and semiconductor doping capabilities of large borane clusters. In: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 21 (24). pp. 12916-12923.
Ghorai, Sagar and Jemmis, Eluvathingal D (2018) B-B Coupling and B-B Catenation: Computational Study of the Structure and Reactions of Metal-Bis(borylene) Complexes. In: CHEMISTRY-A EUROPEAN JOURNAL, 24 (67). pp. 17844-17851.
Joy, Jyothish and Akhil, Edakkandy and Jemmis, Eluvathingal D (2018) Halogen bond shortens and strengthens the bridge bond of 1.1.1]propellane and the open form of 2.2.2]propellane. In: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 20 (40). pp. 25792-25798.
Mondal, Bijan and Bag, Ranjit and Ghorai, Sagar and Bakthavachalam, K and Jemmis, Eluvathingal D and Ghosh, Sundargopal (2018) Synthesis, Structure, Bonding, and Reactivity of Metal Complexes Comprising Diborane(4) and Diborene(2): {Cp*Mo(CO)(2)}(2){mu-eta(2):eta(2)-B2H4}] and {Cp*M(CO)(2)}(2)B2H2M(CO)(4)], M=Mo,W. In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 57 (27). pp. 8079-8083.
Ramakrishnan, Shyama and Jemmis, Eluvathingal D (2018) Origin of beta-agostic interaction in d(0) transition metal alkyl complexes: Influence of ligands. In: JOURNAL OF ORGANOMETALLIC CHEMISTRY, 865 (SI). pp. 37-44.
Marutheeswaran, S and Jemmis, Eluvathingal D (2018) Adamantane-Derived Carbon Nanothreads: High Structural Stability and Mechanical Strength. In: JOURNAL OF PHYSICAL CHEMISTRY C, 122 (14). pp. 7945-7950.
Ghosh, Sourav and Roy, Punarbasu and Karmodak, Naiwrit and Jemmis, Eluvathingal D and Mugesh, Govindasamy (2018) Nanoisozymes: Crystal-Facet-Dependent Enzyme-Mimetic Activity of V2O5 Nanomaterials. In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 57 (17). pp. 4510-4515.
Karmodak, Naiwrit and Jemmis, Eluvathingal D (2018) Metal Templates and Boron Sources Controlling Borophene Structures: An Ab lnitio Study. In: JOURNAL OF PHYSICAL CHEMISTRY C, 122 (4). pp. 2268-2274.
Ramaraj, A and Reddy, K Hari Krishna and Keil, Helena and Herbst-Irmer, Regine and Stalke, Dietmar and Jemmis, Eluvathingal D and Jagirdar, Balaji R (2017) Approaches to Sigma Complexes via Displacement of Agostic Interactions: An Experimental and Theoretical Investigation. In: ORGANOMETALLICS, 36 (15). pp. 2736-2745.
Kannan, Ramkumar and Kumar, Sandeep and Andrews, Alex P and Jemmis, Eluvathingal D and Venugopal, Ajay (2017) Consequence of Ligand Bite Angle on Bismuth Lewis Acidity. In: INORGANIC CHEMISTRY, 56 (16). 9391+.
Joy, Jyothish and Jemmis, Eluvathingal D (2017) Contrasting Behavior of the Z Bonds in X-Z ... Y Weak Interactions: Z = Main Group Elements Versus the Transition Metals. In: INORGANIC CHEMISTRY, 56 (3). pp. 1132-1143.
Ghorai, Sagar and Jemmis, Eluvathingal D (2017) A DFT Study on the Stabilization of the B equivalent to B Triple Bond in a Metallaborocycle: Contrasting Electronic Structures of Boron and Carbon Analogues. In: CHEMISTRY-A EUROPEAN JOURNAL, 23 (41). pp. 9746-9751.
Karmodak, Naiwrit and Jemmis, Eluvathingal D (2017) Fragment approach to the electronic structure of tau -boron allotrope. In: PHYSICAL REVIEW B, 95 (16).
Karmodak, Naiwrit and Jemmis, Eluvathingal D (2017) The Role of Holes in Borophenes: An Ab Initio Study of Their Structure and Stability with and without Metal Templates. In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 56 (34). pp. 10093-10097.
Karmodak, Naiwrit and Jemmis, Eluvathingal D (2017) The dynamic behavior of the exohedral transition metal complexes of B-40 : eta(6)- and eta(7)-B40Cr(CO)(3) and Cr(CO)(3)-eta(7)-B-40-eta(7)-Cr(CO)(3). In: JOURNAL OF CHEMICAL SCIENCES, 129 (7, SI). pp. 1061-1067.
Joy, Jyothish and Jemmis, Eluvathingal D (2017) A halogen bond route to shorten the ultrashort sextuple bonds in Cr-2 and Mo-2. In: CHEMICAL COMMUNICATIONS, 53 (58). pp. 8168-8171.
Priyakumari, Chakkingal P and Jemmis, Eluvathingal D (2016) Computational design of Oligo-sulfuranes. In: JOURNAL OF CHEMICAL SCIENCES, 128 (10). pp. 1663-1669.
Joy, Jyothish and Jose, Anex and Jemmis, Eluvathingal D (2016) Continuum in the X-Z-Y Weak Bonds: Z= Main Group Elements. In: JOURNAL OF COMPUTATIONAL CHEMISTRY, 37 (2, SI). pp. 270-279.
Karmodak, Naiwrit and Jemmis, Eluvathingal D (2016) Exohedral Complexation of B-40, C-60 and Arenes with Transition Metals: A Comparative DFT Study. In: CHEMISTRY-AN ASIAN JOURNAL, 11 (23). pp. 3350-3354.
Sharma, Chiranjeev and Singh, Ashawani K and Joy, Jyothish and Jemmis, Eluvathingal D and Awasthi, Satish Kumar (2016) Experimental and theoretical study of intramolecular O center dot center dot center dot O interaction in structurally rigid beta-keto carboxylic esters. In: RSC ADVANCES, 6 (94). pp. 91689-91693.
Ramanathan, N and Sundararajan, K and Vidya, K and Jemmis, Eluvathingal D (2016) Non-covalent C-Cl center dot center dot center dot pi interaction in acetylene-carbon tetrachloride adducts: Matrix isolation infrared and ab initio computational studies. In: SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 157 . pp. 69-78.
Sharma, Chiranjeev and Joy, Jyothish and Nethaji, Munirathinam and Jemmis, Eluvathingal D and Awasthi, Satish Kumar (2016) Synthetic, Crystallographic, and Computational Studies of Extensively Hydrogen Bonded Bilayers in Thermally Stable Adamantane Hydroperoxides. In: ASIAN JOURNAL OF ORGANIC CHEMISTRY, 5 (11). pp. 1398-1405.
Kumar, Rahul and Ramakrishnan, Shyama and Jemmis, Eluvathingal D and Jagirdar, Balaji R (2015) Implication of a sigma-Methane Complex en Route to Elimination of Methane from a Ruthenium Complex: An Experimental and Theoretical Investigation. In: ORGANOMETALLICS, 34 (7). pp. 1245-1254.
Joy, Jyothish and Jemmis, Eluvathingal D and Vidya, Kaipanchery (2015) Negative hyperconjugation and red-, blue- or zero-shift in X-Z center dot center dot center dot Y complexes. In: FARADAY DISCUSSIONS, 177 . pp. 33-50.
Vidya, Kaipanchery and Jemmis, Eluvathingal D (2015) Relative stabilities of condensed face sharing mono- and di-carboranes: CB20H18 and C2B19H18+. In: JOURNAL OF ORGANOMETALLIC CHEMISTRY, 798 (1). pp. 91-98.
Wang, Changwei and Mo, Yirong and Wagner, Philipp J and Schreiner, Peter R and Jemmis, Eluvathingal D and Danovich, David and Shaik, Sason (2015) The Self-Association of Graphane Is Driven by London Dispersion and Enhanced Orbital Interactions. In: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 11 (4). pp. 1621-1630.
Mallick, Dibyendu and Jemmis, Eluvathingal D (2015) Structural variations in aromatic 2 pi-electron three-membered rings of the main group elements. In: JOURNAL OF CHEMICAL SCIENCES, 127 (2, SI). pp. 183-196.
Vidya, Kaipanchery and Jemmis, Eluvathingal D (2014) Designing stuffed hetero-fullerene nano-clusters: C26B46N12 and C14B58N12Li12. In: RSC ADVANCES, 4 (57). pp. 30013-30018.
Roy, Subhendu and Rosenthal, Uwe and Jemmis, Eluvathingal D (2014) Metallacyclocumulenes: A Theoretical Perspective on the Structure, Bonding, and Reactivity. In: ACCOUNTS OF CHEMICAL RESEARCH, 47 (10). pp. 2917-2930.
Priyakumari, Chakkingal P and Jemmis, Eluvathingal D (2013) P3F92-: An All-Pseudo-pi* 2 pi-Aromatic. In: JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 135 (43). pp. 16026-16029.
Mukherjee, Raja and Mondal, Sayantan and Basak, Amit and Mallick, Dibyendu and Jemmis, Eluvathingal D (2012) Reactivity of Bispropargyl Sulfones under Basic Conditions: Interplay Between Garratt-Braverman and Schmittel/Myers-Saito Cyclization Pathway. In: CHEMISTRY-AN ASIAN JOURNAL, 7 (5). pp. 957-965.
Roy, Subhendu and Jemmis, Eluvathingal D and Schulz, Axel and Beweries, Torsten and Rosenthal, Uwe (2012) Theoretical Evidence of the Stabilization of an Unusual Four-Membered Metallacycloallene by a Transition-Metal Fragment. In: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 51 (22). pp. 5347-5350.
Haehnel, Martin and Ruhmann, Martin and Theilmann, Oliver and Roy, Subhendu and Beweries, Torsten and Arndt, Perdita and Spannenberg, Anke and Villinger, Alexander and Jemmis, Eluvathingal D and Schulz, Axel and Rosenthal, Uwe (2012) Reactions of Titanocene Bis(trimethylsilyl)acetylene Complexes with Carbodiimides: An Experimental and Theoretical Study of Complexation versus C-N Bond Activation. In: JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 134 (38). pp. 15979-15991.
