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RESEARCH PAPER · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2012

Characterization, photophysical and DFT calculation study on 2-(2,4-difluorophenyl)-1-(4-methoxyphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline ligand

Jayaraman Jayabharathi, Venugopal Thanikachalam, Marimuthu Venkatesh Perumal

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Characterization, photophysical and DFT calculation study on 2-(2,4-difluorophenyl)-1-(4-methoxyphenyl)-1H-imidazo[4,5-f][1,10]phenanthroline ligandOriginalElectronic properties of phenanthrimidazoles as hole transport materials in organic light emitting devices and in photoelectron transfer to ZnO nanoparticles13Experimental and DFT studies on the vibrational and electronic spectra of 2-(1H-Imidazo [4,5-ƒ][1,10]phenanthrolin-2-yl)phenol17Synthesis, characterization, thermal behavior, and DFT aspects of some oxovanadium(IV) complexes involving ONO-donor sugar Schiff bases29Oxidovanadium(IV) complexes involving dehydroacetic acid and β-diketones of bioinorganic and medicinal relevance: Their synthesis, characterization, thermal behavior and DFT aspects28Synthesis, structural characterization and theoretical approach of the tri(2-(2,6-dichlorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline) cobalt(II)6Mixed-ligand cobalt(II) complexes of bioinorganic and medicinal relevance, involving dehydroacetic acid and β-diketones: Their synthesis, hyphenated experimental-DFT, thermal and bactericidal facets37Nickel(II) complexes of ONS donor Schiff base ligands: synthesis, combined DFT-experimental characterization, redox, thermal, and in vitro biological investigation37Synthesis and Conjoint Experimental-DFT Characterization of Some Pyrazolone Functionalized Dioxovanadium (V) Schiff Base Complexes4A rational synthesis of a novel imidazo[4,5-f][1,10]phenanthroline templated Schiff base: Characterization, photoluminescence and DFT/TD-DFT study4Corrosion resistance and thermal behavior of acetylacetonato-oxoperoxomolybdenum(VI) complex of maltol: Experimental and DFT studies30Conjoint experimental–theoretical evaluation of pyrone-salicylic acid hydrazide copper(II) Schiff base complexes: their synthesis, SOD and electrochemical fronts17Nitric oxide functionalized molybdenum(0) pyrazolone Schiff base complexes: thermal and biochemical study26A new Ru(II) carbonyl complex of 2-benzoylpyridine: medicinal and material evaluation at the computational–experimental convergence20cis-Dioxomolybdenum(VI) complex of N-o-hydroxyacetophenonene-isonicotinic acid hydrazide as nosocomial anti-infectious agent: experimental and theoretical study13Quinoline and pyrazolone functionalized cis-dioxomolybdenum(VI) complexes: synthesis, hyphenated experimental-DFT studies and bactericidal implications12Synthesis, characterization, crystal structure and DFT studies of a palladium(II) complex with an asymmetric Schiff base ligand56Structural and spectroscopic characterization and DFT studies of 2-amino-1,10-phenanthrolin-1-ium chloride0Imidazo[4,5-f][1,10]phenanthroline complexes with Fe2+, Cd2+, Co2+ and Zn2+ ions4Synthesis, spectral, FMOs and NLO properties based on DFT calculations of dioxidomolybdenum(VI) complex11pH-Responsive luminescence sensing, photoredox catalysis and photodynamic applications of ruthenium(II) photosensitizers bearing imidazo[4,5-f][1,10]phenanthroline scaffolds47Synthesis, single crystal structures, DFT and in vitro anti oxidant superoxide dismutase studies of copper(II) complexes derived from the di-(2-picolyl)amine and co-ligands: Promising antioxidants8A fundamental role of the solvent polarity and remote substitution of the 2-(4-R-phenyl)-1 H -imidazo[4,5- f ][1,10]phenanthroline framework in controlling the ground- and excited-state properties of Re( i ) chromophores [ReCl(CO) 3 (R-C 6 H 4 -imphen)]12Theoretical, antioxidant, antidiabetic and in silico molecular docking and pharmacokinetics studies of heteroleptic oxovanadium(IV) complexes of thiosemicarbazone-based ligands and diclofenac25Construction of Hydration Layer for Proton Transport by Implanting the Hydrophilic Center Ag 0 in Nickel Metal‐Organic Frameworks10Facile CeO2 Nanoparticles Catalysed the Synthesis of a Series of 2,4,5-Trisubstituted Imidazole Derivatives and their DFT Studies for NLO Application0

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  1. Electronic properties of phenanthrimidazoles as hole transport materials in organic light emitting devices and in photoelectron transfer to ZnO nanoparticles

    Journal of Physical Organic Chemistry · 2013-04-02

    Chockalingam Karunakaran, Jayaraman Jayabharathi, Marimuthu Venkatesh Perumal, Venugopal Thanikachalam, Prasoon Kumar Thakur

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  2. Experimental and DFT studies on the vibrational and electronic spectra of 2-(1H-Imidazo [4,5-ƒ][1,10]phenanthrolin-2-yl)phenol

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013-08-09

    Tingting Tang, Guodong Tang, Shanshan Kou, Jianyin Zhao, Lance F. Culnane, Yu Long Zhang

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  3. Synthesis, characterization, thermal behavior, and DFT aspects of some oxovanadium(IV) complexes involving ONO-donor sugar Schiff bases

    Journal of Coordination Chemistry · 2014-09-01

    RAM CHARITRA MAURYA, Bashir Ahmad Malik, Jan Mohammad Mir, Arun Sharma

    Read original paper ↗ ·

  4. Oxidovanadium(IV) complexes involving dehydroacetic acid and β-diketones of bioinorganic and medicinal relevance: Their synthesis, characterization, thermal behavior and DFT aspects

    Journal of Molecular Structure · 2014-11-18

    RAM CHARITRA MAURYA, Bashir Ahmad Malik, Jan Mohammad Mir, P. Vishwakarma

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  5. Synthesis, structural characterization and theoretical approach of the tri(2-(2,6-dichlorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline) cobalt(II)

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2015-03-04

    Yiwei Wang, Yu Long Zhang, Dunru Zhu, Kui‐Rong Ma, Haiwei Ni, Guodong Tang

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  6. Mixed-ligand cobalt(II) complexes of bioinorganic and medicinal relevance, involving dehydroacetic acid and β-diketones: Their synthesis, hyphenated experimental-DFT, thermal and bactericidal facets

    Journal of Molecular Structure · 2015-06-13

    RAM CHARITRA MAURYA, Bashir Ahmad Malik, Jan Mohammad Mir, P. Vishwakarma, Deepak Kumar Rajak, N. Jain

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  7. Nickel(II) complexes of ONS donor Schiff base ligands: synthesis, combined DFT-experimental characterization, redox, thermal, and in vitro biological investigation

    Journal of Coordination Chemistry · 2015-06-22

    RAM CHARITRA MAURYA, Bashir Ahmad Malik, Jan Mohammad Mir, P. Vishwakarma, Deepak Kumar Rajak, N. Jain

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  8. Synthesis and Conjoint Experimental-DFT Characterization of Some Pyrazolone Functionalized Dioxovanadium (V) Schiff Base Complexes

    Journal of Theoretical and Computational Science · 2017-01-01

    Jan Mohammad Mir, Maurya Rc, P. Vishwakarma, Deepak Kumar Rajak, Malik BA, Pushpendra Singh Jaget, P. Bohre

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  9. A rational synthesis of a novel imidazo[4,5-f][1,10]phenanthroline templated Schiff base: Characterization, photoluminescence and DFT/TD-DFT study

    Bulletin of the Chemical Society of Ethiopia · 2017-07-19

    Selami Karslıoğlu, Serkan Demir, H. Yılmaz, Semih Gördük

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  10. Corrosion resistance and thermal behavior of acetylacetonato-oxoperoxomolybdenum(VI) complex of maltol: Experimental and DFT studies

    Karbala International Journal of Modern Science · 2017-10-11

    Jan Mohammad Mir, RAM CHARITRA MAURYA, P. Vishwakarma

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  11. Conjoint experimental–theoretical evaluation of pyrone-salicylic acid hydrazide copper(II) Schiff base complexes: their synthesis, SOD and electrochemical fronts

    Journal of the Chinese Advanced Materials Society · 2017-12-01

    Jan Mohammad Mir, P. Vishwakarma, RAM CHARITRA MAURYA

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  12. Nitric oxide functionalized molybdenum(0) pyrazolone Schiff base complexes: thermal and biochemical study

    RSC Advances · 2018-01-01

    Jan Mohammad Mir, RAM CHARITRA MAURYA

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  13. A new Ru(II) carbonyl complex of 2-benzoylpyridine: medicinal and material evaluation at the computational–experimental convergence

    Journal of the Chinese Advanced Materials Society · 2018-04-03

    Jan Mohammad Mir, RAM CHARITRA MAURYA

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  14. cis-Dioxomolybdenum(VI) complex of N-o-hydroxyacetophenonene-isonicotinic acid hydrazide as nosocomial anti-infectious agent: experimental and theoretical study

    Journal of the Chinese Advanced Materials Society · 2018-05-25

    Jan Mohammad Mir, Siddhant Roy, P. Vishwakarma, RAM CHARITRA MAURYA

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  15. Quinoline and pyrazolone functionalized cis-dioxomolybdenum(VI) complexes: synthesis, hyphenated experimental-DFT studies and bactericidal implications

    Journal of Coordination Chemistry · 2018-10-03

    Jan Mohammad Mir, P. Vishwakarma, Siddhant Roy, RAM CHARITRA MAURYA

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  16. Synthesis, characterization, crystal structure and DFT studies of a palladium(II) complex with an asymmetric Schiff base ligand

    Journal of Molecular Structure · 2018-11-22

    Hadi Kargar, Vajiheh Torabi, Alireza Akbari, Reza Behjatmanesh‐Ardakani, Muhammad Nawaz Tahir

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  17. Structural and spectroscopic characterization and DFT studies of 2-amino-1,10-phenanthrolin-1-ium chloride

    European Journal of Chemistry · 2019-06-30

    Sebile Işık Büyükekşi, Namık Özdemir, Abdurrahman Şengül

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  18. Imidazo[4,5-f][1,10]phenanthroline complexes with Fe2+, Cd2+, Co2+ and Zn2+ ions

    Mendeleev Communications · 2020-07-01

    Токарев Сергей Дмитриевич, Yu. V. Fedorov, Olga Anatol'evna Fedorova

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  19. Synthesis, spectral, FMOs and NLO properties based on DFT calculations of dioxidomolybdenum(VI) complex

    Journal of Coordination Chemistry · 2021-02-13

    Mahendra Kumar Parte, P. Vishwakarma, Pushpendra Singh Jaget, RAM CHARITRA MAURYA

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  20. pH-Responsive luminescence sensing, photoredox catalysis and photodynamic applications of ruthenium(II) photosensitizers bearing imidazo[4,5-f][1,10]phenanthroline scaffolds

    Coordination Chemistry Reviews · 2021-11-03

    Sushil Kumar, Siddhant Singh, Arun Kumar, K. S. R. Murthy, Alok Kumar Singh

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  21. Synthesis, single crystal structures, DFT and in vitro anti oxidant superoxide dismutase studies of copper(II) complexes derived from the di-(2-picolyl)amine and co-ligands: Promising antioxidants

    Polyhedron · 2021-12-02

    Satish Kumar Patel, Ram N. Patel, Abhay Kumar Patel, Neetu Patel, Isabel Coloma, Miguel Cortijo, Santiago Herrero, Duane Choquesillo‐Lazarte

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  22. A fundamental role of the solvent polarity and remote substitution of the 2-(4-R-phenyl)-1 H -imidazo[4,5- f ][1,10]phenanthroline framework in controlling the ground- and excited-state properties of Re( i ) chromophores [ReCl(CO) 3 (R-C 6 H 4 -imphen)]

    Dalton Transactions · 2022-01-01

    Agata Szłapa‐Kula, Joanna Palion‐Gazda, Przemysław Ledwon, Karol Erfurt, B. Machura

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  23. Theoretical, antioxidant, antidiabetic and in silico molecular docking and pharmacokinetics studies of heteroleptic oxovanadium(IV) complexes of thiosemicarbazone-based ligands and diclofenac

    Journal of Biomolecular Structure and Dynamics · 2023-08-20

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  24. Construction of Hydration Layer for Proton Transport by Implanting the Hydrophilic Center Ag 0 in Nickel Metal‐Organic Frameworks

    Small · 2023-11-27

    Yang Cui, Dongyang Li, Zhichao Shao, Yujie Zhao, Kangshuai Geng, Jing Huang, Yatao Zhang, Hongwei Hou

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  25. Facile CeO2 Nanoparticles Catalysed the Synthesis of a Series of 2,4,5-Trisubstituted Imidazole Derivatives and their DFT Studies for NLO Application

    Letters in Organic Chemistry · 2025-02-13

    Y. Surendranaik, Talavara Venkatesh, Jayachandu M.E.

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