Seranthimata Samshuddin

Dr. Seranthimata Samshuddin

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Research Focus & Metrics

Academic Career Length

18Years (2009-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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1 March 2014 in Optics & Laser Technology
Verified
Journal Article
Closed access
LKLaxminarayana Kamath
Laxminarayana Kamath
KMK.B. Manjunatha
K.B. Manjunatha
SSSeetharam Shettigar
Seetharam Shettigar
GUG. Umesh
G. Umesh
BNB. Narayana
B. Narayana
BSB.K. Sarojini
B.K. Sarojini

28 July 2017 in Journal of Bio- and Tribo-Corrosion
Verified
Journal Article
Closed access
PDF file
NSN. Phadke Swathi
N. Phadke Swathi
VAVijaya D. P. Alva
Vijaya D. P. Alva
SSSeranthimata Samshuddin
Seranthimata Samshuddin

9 July 2011 in Medicinal Chemistry Research
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Journal Article
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SSSeranthimata Samshuddin
Seranthimata Samshuddin
BNBadiadka Narayana
Badiadka Narayana
BSBalladka Kunhanna Sarojini
Balladka Kunhanna Sarojini
MKMahmud Tareq Hassan Khan
Mahmud Tareq Hassan Khan
HYHemmige S. Yathirajan
Hemmige S. Yathirajan
RRRamappa Raghavendra
Ramappa Raghavendra

10 February 2010 in Acta Crystallographica Section E Crystallographic Communications
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Journal Article
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HFHoong-Kun Fun
Hoong-Kun Fun
MHMadhukar Hemamalini
Madhukar Hemamalini
SSSeranthimata Samshuddin
Seranthimata Samshuddin
BNB. Narayana
B. Narayana
HYH. S. Yathirajan
H. S. Yathirajan
In the asymmetric unit of the title compound, C(17)H(14)F(2)N(2)O, there are three independent mol-ecules (A, B and C) which differ slightly in the relative orientations of the two fluoro-phenyl rings. In mol-ecules A and C one of the fluoro-phenyl rings is disordered over two positions, with occupancy ratios of 0.72 (2):0.28 (2) for mol-ecule A and 0.67 (2):0.33 (2) for mol-ecule C. The dihedral angle between the two fluoro-phenyl rings in the independent mol-ecules lie in the range 70.3 (3)-84.0 (3)°. In the crystal structure, the mol-ecules are linked via inter-molecular C-H⋯O and C-H⋯F hydrogen bonds and π⋯π stacking inter-actions [centroid-centroid distance = 3.7508 (13) Å], forming a three-dimensional network.

17 March 2010 in Acta Crystallographica Section E Crystallographic Communications
Verified
Journal Article
Open access
PDF file
HFHoong-Kun Fun
Hoong-Kun Fun
MHMadhukar Hemamalini
Madhukar Hemamalini
SSSeranthimata Samshuddin
Seranthimata Samshuddin
BNB. Narayana
B. Narayana
HYH. S. Yathirajan
H. S. Yathirajan
The 3-cyclo-hexene units adopt envelope conformations in each of the two independent mol-ecules that comprise the asymmetric unit of the title compound, C(20)H(16)F(2)O(3). The dihedral angles between the two fluoro-phenyl rings are 79.7 (2) and 73.7 (2)° in the two mol-ecules. In one of the mol-ecules, two C-H groups of the cyclo-hexene ring are disordered over two sets of sites in a 0.818 (13):0.182 (13) ratio, the major and minor components corresponding to the two enanti-omeric forms of the mol-ecule. Weak inter-molecular C-H⋯O inter-actions help to stabilize the crystal structure.

3 June 2019 in Polycyclic Aromatic Compounds
Verified
Journal Article
Closed access
YMY. Sheena Mary
Y. Sheena Mary
Renjith ThomasRenjith Thomas
Renjith Thomas
BNB. Narayana
B. Narayana
SSSeranthimata Samshuddin
Seranthimata Samshuddin
BSB. K. Sarojini
B. K. Sarojini
GPGirinath G. Pillai
Girinath G. Pillai
Theoretical calculations at the B3LYP/CC-pVDZ level were used to find the IR, Raman, VCD, and various molecular properties of a terphenyl derivative. Experimental and theoretical spectra agree within their respective limits. Partial density of states shows which parts of the molecules have the most important contribution to the FMO. Fluorine, sulfur, oxygen, and nitrogen atoms have practically insignificant contribution to the HOMO. Time dependent DFT calculations were used to study excitations, while natural transition orbitals were used to study the charge transfer in the strongest excitation. The experimentally observed FTIR modes are compared with calculated wavenumbers. Natural bond orbital analysis gives the idea about stability of molecules. MD simulations are used for calculating solubility parameters. Autoxidation and bond dissociation studies indicate stability of the compound. The docked ligands form secure complexes with the receptor methionyl-tRNA synthetase which indicates new anti-protozoan drugs.
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