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1

Is delocalization a prerequisite for stability of ring systems? A case study of some inorganic rings

Phukan, Ashwini K., Guha, Ankur Kanti, Silvi, Bernard

Journal:

Dalton Transactions

Year:

2010

Language:

english

File:

PDF, 448 KB

english, 2010

2

Theoretical study on the mechanism of catalytic reduction of hydrazine to ammonia mediated by vanadium (III) thiolate complexes

Ankur Kanti Guha, Ashwini K. Phukan

Journal:

Inorganica Chimica Acta

Year:

2010

Language:

english

File:

PDF, 436 KB

english, 2010

3

Theoretical Study on the Effect of Annelation and Carbonylation on the Electronic and Ligand Properties of N -Heterocyclic Silylenes and Germylenes: Carbene Comparisons begin To Break Down

Guha, Ankur Kanti, Phukan, Ashwini K.

Journal:

Journal of Organic Chemistry

Year:

2014

Language:

english

File:

PDF, 372 KB

english, 2014

4

A theoretical study on antioxidant activity of ferulic acid and its ester derivatives

Borgohain, Romesh, Handique, Jyotirekha G., Guha, Ankur Kanti, Pratihar, Sanjay

Journal:

Journal of Theoretical and Computational Chemistry

Year:

2016

Language:

english

File:

PDF, 849 KB

english, 2016

5

Stabilization of Si(0) and Ge(0) compounds by different silylenes and germylenes: a density functional and molecular electrostatic study

Sarmah, Satyajit, Guha, Ankur Kanti, Phukan, Ashwini K., Kumar, Anmol, Gadre, Shridhar R.

Journal:

Dalton Transactions

Year:

2013

Language:

english

File:

PDF, 2.44 MB

english, 2013

6

Heterocyclic carbenes of diverse flexibility: A theoretical insight

Ankur Kanti Guha, Chandan Das, Ashwini K. Phukan

Journal:

Journal of Organometallic Chemistry

Year:

2011

Language:

english

File:

PDF, 653 KB

english, 2011

7

Stabilization of cyclic and acyclic carbon(0) compounds by differential coordination of heterocyclic carbenes: a theoretical assessment

Phukan, Ashwini K., Guha, Ankur Kanti

Journal:

Dalton Transactions

Year:

2012

Language:

english

File:

PDF, 3.01 MB

english, 2012

8

Graphene oxide-filled conducting polyaniline composites as methanol-sensing materials

Konwer, Surajit, Guha, Ankur Kanti, Dolui, Swapan K.

Journal:

Journal of Materials Science

Year:

2013

Language:

english

File:

PDF, 731 KB

english, 2013

9

Ligand Properties of Boron-Substituted Five-, Six-, and Seven-Membered Heterocyclic Carbenes: A Theoretical Study

Phukan, Ashwini K., Guha, Ankur Kanti, Sarmah, Satyajit

Journal:

Organometallics

Year:

2013

Language:

english

File:

PDF, 1.14 MB

english, 2013

10

Do Carbenes Have a “Hidden” Carbon(0) Character? Revisiting the Electronic Structure of 2,2′-Bipyridyl Carbene

Ankur Kanti Guha, Dr. Ashwini K. Phukan

Journal:

Chemistry - A European Journal

Year:

2012

Language:

english

File:

PDF, 829 KB

english, 2012

11

High- performance aqueous electrolyte based supercapacitor of carboxylic acid functionalized carbon-nanotubes and graphene nano composite

Saikia, Pranjal, Dutta, Kaushik, Guha, Ankur Kanti, Dolui, S.K., Barman, Pranjit, Borthakur, Lakhya Jyoti

Journal:

Materials Chemistry and Physics

Year:

2021

File:

PDF, 8.30 MB

2021

12

Effect of substituents at the heteroatom on the structure and ligating properties of carbodicarbenes and its silicon analogs: a theoretical study

Ankur Kanti Guha, Bidisha Konwar, Satyajit Sarmah, Ashwini K. Phukan

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2012

Language:

english

File:

PDF, 837 KB

english, 2012

13

In Silico Search for Boron-Beryllium Dative Bond

Kalita, Amlan Jyoti, Rohman, Shahnaz S., Kashyap, Chayanika, Ullah, Sabnam S., Chakraborty, Antara, Guha, Ankur Kanti

Journal:

European Journal of Inorganic Chemistry

Year:

2020

File:

PDF, 1.25 MB

2020

14

Why Vanadium Complexes Perform Poorly in Comparison to Related Molybdenum Complexes in the Catalytic Reduction of Dinitrogen to Ammonia (Schrock Cycle): A Theoretical Study

Guha, Ankur Kanti, Phukan, Ashwini K.

Journal:

Inorganic Chemistry

Year:

2011

Language:

english

File:

PDF, 1.33 MB

english, 2011

15

Electronic and Ligand Properties of Annelated Normal and Abnormal (Mesoionic) N -Heterocyclic Carbenes: A Theoretical Study

Phukan, Ashwini K., Guha, Ankur Kanti, Sarmah, Satyajit, Dewhurst, Rian D.

Journal:

Journal of Organic Chemistry

Year:

2013

Language:

english

File:

PDF, 1.22 MB

english, 2013

16

Tracing the Route to Ammonia: A Theoretical Study on the Possible Pathways for Dinitrogen Reduction with Tripodal Iron Complexes

Gogoi, Ujjal, Guha, Ankur Kanti, Phukan, Ashwini K.

Journal:

Chemistry - A European Journal

Year:

2013

Language:

english

File:

PDF, 1.18 MB

english, 2013

17

Structural, electronic and reactivity studies on group 15 analogues ofN-heterocyclic carbene

Borpuzari, Manash Protim, Guha, Ankur Kanti, Kar, Rahul

Journal:

Structural Chemistry

Year:

2015

Language:

english

File:

PDF, 1.07 MB

english, 2015

18

Spectroscopic Distinction of Different Carbon Bases: An Insight from Theory

Guha, Ankur Kanti, Borthakur, Bitupon, Phukan, Ashwini K.

Journal:

Journal of Organic Chemistry

Year:

2015

Language:

english

File:

PDF, 571 KB

english, 2015

19

Donor stabilized borylnitrenes: A theoretical study

Ullah, Sabnam S., Sharma, Pankaz K., Guha, Ankur Kanti

Journal:

Computational and Theoretical Chemistry

Year:

2017

Language:

english

File:

PDF, 1.18 MB

english, 2017

20

Synthesis, characterization and DFT studies of electron-rich iridium(I) carbonyl complexes of an unsymmetrical phosphine–phosphine monoselenide ligand and their reactivity towards alkyl halides

Sarmah, Bhaskar Jyoti, Guha, Ankur Kanti, Nath, Jayashree, Saikia, Lakshi

Journal:

Year:

2020

File:

PDF, 1.07 MB

2020

21

Pd( ii ) coordinated deprotonated diphenyl phosphino amino pyridine: reactivity towards solvent, base, and acid

Pratihar, Sanjay, Pegu, Rupa, Guha, Ankur Kanti, Sarma, Bipul

Journal:

Dalton Transactions

Year:

2014

Language:

english

File:

PDF, 1.34 MB

english, 2014

22

Non-covalent Interaction in Benzene and Substituted Benzene: A Theoretical Study

Kashyap, Chayanika, Ullah, Sabnam S., Mazumder, Lakhya J., Kanti Guha, Ankur

Journal:

Computational and Theoretical Chemistry

Year:

2018

Language:

english

File:

PDF, 982 KB

english, 2018

23

Switching of carbene spin states: effect of hydrogen bond donors

Guha, Ankur Kanti, Boruah, Abhijit, Hazarika, Munmi, Kaman, Sumi

Journal:

Reports in Theoretical Chemistry

Year:

2015

Language:

english

File:

PDF, 676 KB

english, 2015

24

Double aromaticity in BBe6H6+ cluster with planar hexacoordinate boron

Kalita, Amlan J, Rohman, Shahnaz Sultana, Kashyap, Chayanika, Ullah, Sabman Swabaka, Guha, Ankur Kanti

Journal:

Chemical Communications

Year:

2020

File:

PDF, 1.36 MB

2020

25

Donor-Acceptor Complexes of Normal and Abnormal N-Heterocyclic Carbenes with Group 13 (B, Al, Ga) Elements: A Combined DFT and Atoms-in-Molecules Study

Sarmah, Satyajit, Guha, Ankur Kanti, Phukan, Ashwini K.

Journal:

European Journal of Inorganic Chemistry

Year:

2013

Language:

english

File:

PDF, 727 KB

english, 2013

26

Transition metal carbon quadruple bond: Viability through single electron transmutation

Kalita, Amlan Jyoti, Rohman, Shahnaz Sultana, Kashyap, Chayanika, Ullah, Sabman Swabaka, Guha, Ankur Kanti

Journal:

Physical Chemistry Chemical Physics

Year:

2020

File:

PDF, 1.38 MB

2020

27

Substrate Oxidation Prompted by Solvent Dissociation: The Role of Peroxo-Vanadate and Ag-π Interaction

Das, Biraj, Sharma, Mukesh, Kashyap, Chayanika, Guha, Ankur Kanti, Hazarika, Anil, Bania, Kusum K

Journal:

Applied Catalysis A: General

Year:

2018

Language:

english

File:

PDF, 1.64 MB

english, 2018

28

Nature of Intramolecular Transannular Interaction in Group 13 Atranes: A Theoretical Study

Phukan, Ashwini K., Guha, Ankur Kanti

Journal:

Inorganic Chemistry

Year:

2011

Language:

english

File:

PDF, 1.64 MB

english, 2011

29

Efficient hydroxylation of benzene to phenol by H2O2 using Ni doped CuWO4 on carbon nitride as catalyst under solar irradiation and its structure activity correlation

Basyach, Purashri, Guha, Ankur Kanti, Borthakur, Sukanya, Kalita, Lisa, Chetia, Pubali, Sonowal, Karanika, Saikia, Lakshi

Journal:

Journal of Materials Chemistry A

Year:

2020

File:

PDF, 2.60 MB

2020

30

Nature of Transannular Interaction in Heavier Group 13 (In, Tl) Atranes: A Theoretical Study

Borthakur, Bitupon, Kanti Guha, Ankur, Phukan, Ashwini K.

Journal:

Year:

2016

Language:

english

File:

PDF, 775 KB

english, 2016

31

N-heterocyclic carbone: computational prediction of a divalent carbon (0) compound

Guha, Ankur Kanti

Journal:

Reports in Theoretical Chemistry

Year:

2015

Language:

english

File:

PDF, 873 KB

english, 2015

32

Trinuclear Mn2+/Zn2+ based microporous coordination polymers as efficient catalysts for ipso-hydroxylation of boronic acids

Bora, Sanchay Jyoti, Paul, Rima, Dutta, Anurag, Goswami, Shyam, Guha, Ankur Kanti, Thakur, Ashim Jyoti

Journal:

Dalton Transactions

Year:

2020

Language:

english

File:

PDF, 3.58 MB

english, 2020

33

Nature of Intramolecular Metal–Metal Interactions in Supported Group 4–Group 9 and Group 6–Group 9 Heterobimetallic Complexes: A Combined Density Functional Theory and Topological Study

Gogoi, Ujjal, Guha, Ankur Kanti, Phukan, Ashwini K.

Journal:

Organometallics

Year:

2011

Language:

english

File:

PDF, 2.94 MB

english, 2011

34

Ultra-Weak Metal-Metal Bonding: Is There a Beryllium-Beryllium Triple Bond?

Rohman, Shahnaz, Kashyap, Chayanika, Ullah, Sabnam, Guha, Ankur Kanti, Mazumder, Lakhya, Sharma, Pankaz

Journal:

Year:

2019

File:

PDF, 1.14 MB

2019

35

Schiff Base Derived from 4,4′-methylenedianiline and p-anisaldehyde: Colorimetric Sensor for Cu2+, Paper Strip Sensor for Al3+ and Fluorescent Sensor for Pb2+

Das, Diganta Kumar, Deka, Satyapriya, Guha, Ankur Kanti

Journal:

Journal of Fluorescence

Year:

2019

File:

PDF, 1.21 MB

2019

36

Crystal structure and homopolar dihydrogen interactions in propanoâbridged indigo

Das, Bidyut, Guha, Ankur Kanti, Wahab, Abdul

Journal:

Journal of Physical Organic Chemistry

Year:

2020

File:

PDF, 3.29 MB

2020

37

Electronic Structure, Stability, and Aromaticity of H 2 B 2 XH (X = N, P) Molecules: A Theoretical Study

Ullah, Sabnam S., Mazumder, Lakhya Jyoti, Kaushik, Samhita, Das, Navanita, Brahma, Mainao Sona, Sharma, Pankaz K., Guha, Ankur Kanti

Journal:

Computational and Theoretical Chemistry

Year:

2017

Language:

english

File:

PDF, 1.07 MB

english, 2017

38

Effect of substituents at the heteroatom on the structure and ligating properties of heterocyclic carbene, silylene, germylene and abnormal carbene: A theoretical study

Guha, Ankur Kanti, Sarmah, Satyajit, Phukan, Ashwini K.

Journal:

Dalton Transactions

Year:

2010

Language:

english

File:

PDF, 401 KB

english, 2010

39

Nature of Transannular Intramolecular Interactions in Group 4 and 6 Metallatranes: A Combined Density Functional Theory and Atoms in Molecules Theory Study

Phukan, Ashwini K., Guha, Ankur Kanti

Journal:

Inorganic Chemistry

Year:

2010

Language:

english

File:

PDF, 2.12 MB

english, 2010

40

Multicenter Bonding in s-Block Metals: An Insight from Theory

Jyoti Kalita, Amlan, Rohman, Shahnaz S., Kashyap, Chayanika, Ullah, Sabnam S., Reza, Sohel, Borah, Bichitra, Kanti Guha, Ankur

Journal:

Computational and Theoretical Chemistry

Year:

2019

Language:

english

File:

PDF, 1.01 MB

english, 2019

41

Revisiting the reactivity of different carbon bases: A theoretical study

Guha, Ankur Kanti, Gogoi, Ujjal, Phukan, Ashwini K.

Journal:

International Journal of Quantum Chemistry

Year:

2013

Language:

english

File:

PDF, 550 KB

english, 2013

42

PdO/CuO Nanoparticles on Zeolite-Y for Nitroarene Reduction and Methanol Oxidation

Sharma, Mukesh, Das, Biraj, Hazarika, Anil, Guha, Ankur Kanti, Bhargava, Suresh Kumar, Bania, Kusum K.

Journal:

ACS Applied Nano Materials

Year:

2019

Language:

english

File:

PDF, 1.97 MB

english, 2019

43

A physiological examination of the antioxidant ability of super tocopherol derivatives

Mazumder, Lakhya Jyoti, Guha, Ankur Kanti, Sharma, Pankaz K.

Journal:

Structural Chemistry

Year:

2020

File:

PDF, 953 KB

2020

44

A selective ratiometric fluoride ion sensor with a (2,4-dinitrophenyl)hydrazine derivative of bis(indolyl) methane and its mode of interaction

Pegu, Rupa, Mandal, Rajesh, Guha, Ankur Kanti, Pratihar, Sanjay

Journal:

New Journal of Chemistry

Year:

2015

Language:

english

File:

PDF, 1.02 MB

english, 2015

45

DFT and TDDFT study on cation-π complexes of diboryne (NHC → B ≡ B←NHC)

Bania, Kusum K., Guha, Ankur Kanti, Bhattacharyya, Pradip K.

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 6.74 MB

english, 2016

46

Selective detection of fluoride via amplified donor-acceptor interaction of 6H-indolo[2,3-b]quinoline

Pegu, Rupa, Pandit, Gopal, Guha, Ankur Kanti, Das, Sajal Kumar, Pratihar, Sanjay

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2018

Language:

english

File:

PDF, 1.38 MB

english, 2018

47

Supramolecular Assembly of Binuclear [V 2 O 3 (NTA) 2 ] 4- unit with [Ce(H 2 O) 9 ] 3+ : Synthesis, Structure, Luminescent, Magnetic Properties and TD-DFT Calculation

Das, Dhiraj, Guha, Ankur Kanti

Journal:

Year:

2017

Language:

english

File:

PDF, 1.12 MB

english, 2017

48

A theoretical study of antioxidant activity of some Schiff bases derived from biologically important phenolic aldehydes and phenylenediamines

Borgohain, Romesh, Handique, Jyotirekha G., Guha, Ankur Kanti, Pratihar, Sanjay

Journal:

Journal of Physical Organic Chemistry

Year:

2017

Language:

english

File:

PDF, 838 KB

english, 2017

49

Schiff Base Derived from 4,4′-methylenedianiline and p-anisaldehyde: Colorimetric Sensor for Cu2+, Paper Strip Sensor for Al3+ and Fluorescent Sensor for Pb2+

Das, Diganta Kumar, Deka, Satyapriya, Guha, Ankur Kanti

Journal:

Journal of Fluorescence

Year:

2019

Language:

english

File:

PDF, 1.21 MB

english, 2019

50

Antioxidant activity of some phenolic aldehydes and their diimine derivatives: A DFT study

Borgohain, Romesh, Guha, Ankur Kanti, Pratihar, Sanjay, Handique, Jyotirekha G.

Journal:

Computational and Theoretical Chemistry

Year:

2015

Language:

english

File:

PDF, 731 KB

english, 2015

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