Deepa Janardanan, Ph. D - Publications

Affiliations: 
Chemistry Central University of Kerala 
Area:
Computational Chemistry

20 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2015 Mandal D, Ramanan R, Usharani D, Janardanan D, Wang B, Shaik S. How does tunneling contribute to counterintuitive H-abstraction reactivity of nonheme Fe(IV)O oxidants with alkanes? Journal of the American Chemical Society. 137: 722-33. PMID 25513834 DOI: 10.1021/Ja509465W  0.76
2015 Mandal D, Ramanan R, Usharani D, Janardanan D, Wang B, Shaik S. How does tunneling contribute to counterintuitive H-abstraction reactivity of nonheme Fe(IV)O oxidants with alkanes? Journal of the American Chemical Society. 137: 722-733. DOI: 10.1021/ja509465w  1
2013 Usharani D, Janardanan D, Li C, Shaik S. A theory for bioinorganic chemical reactivity of oxometal complexes and analogous oxidants: The exchange and orbital-selection rules Accounts of Chemical Research. 46: 471-482. PMID 23210564 DOI: 10.1021/Ar300204Y  1
2013 Wang Y, Janardanan D, Usharani D, Han K, Que L, Shaik S. Nonheme iron oxidant formed in the presence of H2O2 and acetic acid is the cyclic ferric peracetate complex, not a perferryloxo complex Acs Catalysis. 3: 1334-1341. DOI: 10.1021/Cs400134G  1
2012 Janardanan D, Usharani D, Shaik S. The origins of dramatic axial ligand effects: Closed-shell Mn VO complexes use exchange-enhanced open-shell states to mediate efficient H abstraction reactions Angewandte Chemie - International Edition. 51: 4421-4425. PMID 22438238 DOI: 10.1002/Anie.201200689  1
2012 Cho KB, Chen H, Janardanan D, De Visser SP, Shaik S, Nam W. Nonheme iron-oxo and -superoxo reactivities: O 2 binding and spin inversion probability matter Chemical Communications. 48: 2189-2191. PMID 22252386 DOI: 10.1039/C2Cc17610F  1
2011 Janardanan D, Sunoj RB. Chemo-, regio-, and diastereoselectivity preferences in the reaction of a sulfur ylide with a dienal and an enone Organic and Biomolecular Chemistry. 9: 1642-1652. PMID 21253652 DOI: 10.1039/C0Ob00675K  1
2011 Usharani D, Janardanan D, Shaik S. Does the TauD enzyme always hydroxylate alkanes, while an analogous synthetic non-heme reagent always desaturates them? Journal of the American Chemical Society. 133: 176-179. PMID 21171573 DOI: 10.1021/Ja107339H  1
2011 Shaik S, Chen H, Janardanan D. Exchange-enhanced reactivity in bond activation by metal-oxo enzymes and synthetic reagents Nature Chemistry. 3: 19-27. PMID 21160512 DOI: 10.1038/Nchem.1353  1
2011 Janardanan D, Usharani D, Chen H, Shaik S. Modeling C-H abstraction reactivity of nonheme Fe(IV)O oxidants with alkanes: What role do counter ions play? Journal of Physical Chemistry Letters. 2: 2610-2617. DOI: 10.1021/Jz201224X  1
2010 Janardanan D, Wang Y, Schyman P, Que L, Shaik S. The fundamental role of exchange-enhanced reactivity in C-H activation by S = 2 oxo iron(IV) complexes Angewandte Chemie - International Edition. 49: 3342-3345. PMID 20358569 DOI: 10.1002/Anie.201000004  1
2008 Janardanan D, Sunoj RB. Enantio- and diastereoselectivities in chiral sulfur ylide promoted asymmetric aziridination reactions Journal of Organic Chemistry. 73: 8163-8174. PMID 18842028 DOI: 10.1021/Jo800652C  1
2008 Sarkar B, Patra S, Fiedler J, Sunoj RB, Janardanan D, Lahiri GK, Kaim W. Mixed-valent metals bridged by a radical ligand: Fact or fiction based on structure-oxidation state correlations Journal of the American Chemical Society. 130: 3532-3542. PMID 18290644 DOI: 10.1021/Ja077676F  1
2007 Janardanan D, Sunoj RB. Computational investigations on the general reaction profile and diastereoselectivity in sulfur ylide promoted aziridination Chemistry - a European Journal. 13: 4805-4815. PMID 17487905 DOI: 10.1002/Chem.200700303  1
2007 Janardanan D, Sunoj RB. Density functional theory investigations on sulfur ylide promoted cyclopropanation reactions: Insights on mechanism and diastereoselection issues Journal of Organic Chemistry. 72: 331-341. PMID 17221947 DOI: 10.1021/Jo061198U  1
2007 Maji S, Patra S, Chakraborty S, Janardanan D, Mobin SM, Sunoj RB, Lahiri GK. Valence-state distribution in the ruthenium o-quinonoid systems [Ru(trpy)-(Cl)(L1)]+ and [Ru(trpy)(Cl)(L 2)]+ (L1 = o-iminobenzoquinone, L2 = o-diiminobenzoquinone; trpy = 2,2′:6′,2″-terpyridine) European Journal of Inorganic Chemistry. 314-323. DOI: 10.1002/Ejic.200600830  1
2005 Sarkar B, Patra S, Fiedler J, Sunoj RB, Janardanan D, Mobin SM, Niemeyer M, Lahiri GK, Kaim W. Theoretical and experimental evidence for a new kind of spin-coupled singlet species: isomeric mixed-valent complexes bridged by a radical anion ligand. Angewandte Chemie (International Ed. in English). 44: 5655-8. PMID 16078282 DOI: 10.1002/Anie.200501075  1
2005 Kar S, Sarkar B, Ghumaan S, Janardanan D, van Slageren J, Fiedler J, Puranik VG, Sunoj RB, Kaim W, Lahiri GK. 2,5-Dioxido-1,4-benzoquinonediimine (H2L2-), a hydrogen-bonding noninnocent bridging ligand related to aminated topaquinone: different oxidation state distributions in complexes [{(bpy)2Ru}2(mu-H2L)]n (n=0,+,2+,3+,4+) and [{(acac)2Ru}2(mu-H2L)]m (m=2-,-,0,+,2+). Chemistry (Weinheim An Der Bergstrasse, Germany). 11: 4901-11. PMID 15954152 DOI: 10.1002/Chem.200500202  1
2005 Kar S, Sarkar B, Ghumaan S, Janardanan D, Van Slageren J, Fiedler J, Puranik VG, Sunoj RB, Kaim W, Lahiri GK. 2,5-dioxido-1,4-benzoquinonediimine (H2L2 ), A hydrogen-bonding noninnocent bridging ligand related to aminated topaquinone: Different oxidation state distributions in complexes [{(bpy)2Ru} 2(μ-H2L)]n (n = 0, + ,2 + ,3 + ,4+) and [{(acac)2Ru}2(μ-H2L)]m (m = 2-, -,0, + ,2 + ) Chemistry - a European Journal. 11: 4901-4911. DOI: 10.1002/chem.200500202  1
2005 Sarkar B, Patra S, Fiedler J, Sunoj RB, Janardanan D, Mobin SM, Niemeyer M, Lahiri GK, Kaim W. Theoretical and experimental evidence for a new kind of spin-coupled singlet species: Isomeric mixed-valent complexes bridged by a radical anion ligand Angewandte Chemie - International Edition. 44: 5655-5658. DOI: 10.1002/anie.200501075  1
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