نمایش نتایج جستجو برای
نویسنده: Mohamad Vakili
موارد یافت شده: 173
1 - Molecular approach of Au–Stilbene–Au and Au–TCAB–Au molecular optical electronic devices designed for organic light-sensitive circuits (چکیده)2 - Influence of fluorine substitution on the molecular structure, vibrational assignment, Cu–O bond strength and biological properties by comparing copper (II) trifluorobenzoylacetonate and benzoylacetonate complexes (چکیده)
3 - The effect of alkyl substituents in the β-side on the conformation, molecular structure, and copper-oxygen bond strength of bis(β-diketonato)copper(II) complexes by DFT results and experimental vibrational and UV spectra (چکیده)
4 - Impact of Different Groups on Properties of All Members of the Series of 1-X-Benzotriazole Derivatives (X= H, OH, NH2, Cl and CH3) (چکیده)
5 - Clarifying the Vital Role of Fluid Type in Diffusion through Complex Porous Media under Apparently Weak but Essentially Powerful Force of Gravity by Simulations Performed Using Image Processing Technique and D3Q27 Model of Lattice Boltzmann Method (چکیده)
6 - Tautomerism in pyridinyl methyl β-diketones in the liquid and the solid state; a combined computational and experimental study (چکیده)
7 - Tautomerism of pyridinylbutane‐1,3‐diones: An NMR and DFT study (چکیده)
8 - The Computational Study of Fluid Diffusion through Complex Porous Media in the Presence of Gravitational Force and at Different Temperatures Using Image Processing Technique and D3Q27 Model of Lattice Boltzmann Method (چکیده)
9 - Computational studies of chalcogen doped on graphene vs. chalcogen doped on CNT and their role in the catalytic performance of electrochemical CO2 reduction (چکیده)
10 - Transition metals doped ZnS nanocluster for carbon monoxide detection: A DFT study (چکیده)
11 - Electronic transport on the two state “ON–OFF” of 1,3,3-trimethylindolino-6′-nitrobenzopyrylospiran as a light-driven molecular optical switch: A first-principle study (چکیده)
12 - Synthesis, molecular structure, conformational, and intramolecular hydrogen bond strength of ethyl 3-amino-2-butenoate and its N-Me, N-Ph, and N-Bn analogs; An experimental and theoretical study (چکیده)
13 - First-principle study of the current–voltage on the β-diketones with alkyl and methoxy groups at the beta position as molecular switches (چکیده)
14 - Competitor hydrogen-bond acceptors in the SP(NH)3-based structures: Comparison of structural features – Computational/database and experimental (چکیده)
15 - First-principle study on the electronic transport properties of 1,2-bis(2,4-dimethyl-5-phenyl-3-thienyl)perfluorocyclopentene (a diarylethene) as an optical molecular switch (چکیده)
16 - Vibrational spectra, conformation and molecular transport of 5-amino-2,2,6,6-tetramethyl-4-hepten-3-one (چکیده)
17 - Structural and vibrational investigation of Cis–Trans isomers of potent insecticide allethrin (چکیده)
18 - Authentication of potential energy distribution by VEDA in vibrational assignment some of copper (II) of β-diketone complexes (چکیده)
19 - First-principle study on the conductance performance of Salicylidene Ethylamine molecular optical switch and its alkyl halide derivatives (چکیده)
20 - Electrical transport and NDR property on the cis–trans photo-isomerization of (1R,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate as an optical molecular switch; A DFT-NEGF study (چکیده)
21 - Computational modeling of the catalytic cycle of the di-chalcogenide compounds in the capture and release of carbon dioxide: effect of temperature and substitution on the catalytic activity (چکیده)
22 - The I–V characteristics of methyl 3-oxobutanoate as molecular switch (چکیده)
23 - The effect of electrode materials on I–V characteristics behavior of 2,2,6,6-tetramethyl-3,5-heptanedione (a β-diketone) as molecular switch (چکیده)
24 - Electronic transport behavior of 4,6-bis(4-nitrophenyl)-2-phenyl-3,5-diaza-bicyclo[3.1.0]hex-2-ene (a bicyclic aziridine) as optical molecular switch: a first-principles approach (چکیده)
25 - Metal-ligand bond strength in symmetric of Copper (II) β-diketone complexes by UV and TD-DFT approaches (چکیده)
26 - Validation of potential energy distribution by VEDA in vibrational assignment some of Copper (II) complexes with β-diketone ligands (چکیده)
27 - NH Stretching Frequencies of Intramolecularly Hydrogen-Bonded Systems: An Experimental and Theoretical Study (چکیده)
28 - Insight into the computational modeling and reaction mechanism of the catalytic cycle of benzyl-dichalcogenide compounds in capture and release of carbon dioxide (چکیده)
29 - Behaviours of antiviral Oseltamivir in different media: DFT and SQMFF calculations (چکیده)
30 - Electronic transport behavior of 2-amino-4,5-bis(2,5-dimethylthiophen-3-yl)furan-3-carbonitrile (a diarylethene) as optical molecular switch: a first-principles approach (چکیده)
31 - Optimized molecular geometry, vibrational analysis, and Fe-O bond strength of Tris(α-cyanoacetylacetonate)iron(III):An experimental and theoretical study (چکیده)
32 - Isomerism, molecular structure, and vibrational assignment of tris(triflouroacetylacetonato)iron(III): An experimental and theoretical study (چکیده)
33 - Conformational analysis, tautomerization, and vibrational spectra of methyl acetoacetate (چکیده)
34 - Computational modeling in enhanced CO2 and C2H2 capture on chalcogen atom (Se, Te)-decorated graphene: structural and mechanistic aspects (چکیده)
35 - Validation of potential energy distribution by VEDA in vibrational assignment some of β-diketones; comparison of theoretical predictions and experimental vibration shifts upon deutration (چکیده)
36 - Molecular structure, hydrogen bond strength, and infrared Fourier transform vibrational assignment of 2,6-dimethylheptane-3,5-dione (چکیده)
37 - The investigation of the effect of N-glycans on the structure of Trametes versicolor laccase by Molecular dynamics simulation (چکیده)
38 - Molecular structure, intramolecular hydrogen bond strength, vibrational assignment, and spectroscopic insight of 4-phenylamino-3-penten-2-one and its derivatives: A theoretical and experimental study (چکیده)
39 - Voltage–current behavior of 4-phenylamino-3-penten-2-one and its derivatives molecular switch: a first-principles study (چکیده)
40 - Electronic transport behavior of 1-(Phenyldiazenyl)naphthalen-2-ol and its derivatives as optical molecular switches: A first-principles approach (چکیده)
41 - Isomerism, conformation, and structure of Bis(4,4-dimethyl-1-phenylpentane-1,3-dionato)copper(II); A theoretical and spectroscopy approach (چکیده)
42 - Electronic transport properties of 2-nIiitro-4-(6-(4-nitrophenyl)-4-phenyl-1,3-diaza-bicyclo[3.1.0]hex-3-en-2-yl)phenol: A light-driven molecular switch (چکیده)
43 - First-principles study of 2,6-dimethyl-3,5-heptanedione: a β-diketone molecular switch induced by hydrogen transfer (چکیده)
44 - Synthesis, structure, tautomerism, intramolecular hydrogen bond, and vibrational assignment of 3-nitroso-2,4-pentanedione: A theoretical and experimental approach (چکیده)
45 - Conformations, molecular structure, and N–H⋯O hydrogen bond strength in 4-Alkylamino-3-penten-2-ones (چکیده)
46 - Evaluation of degradation in chemical compounds of wood in historical buildings using FT-IR and FT-Raman vibrational spectroscopy (چکیده)
47 - Current–voltage characteristics of β-ketoenamines molecular switches induced by intramolecular hydrogen transfer (چکیده)
48 - مطالعه نظری و تجربی تاتومری مشتقات هالوژنه پارا تری فلوئوروبنزوئیل استون به کمک نظریه تابعی - چگالی و طیف سنجی ارتعاشی (چکیده)
49 - Conformation, molecular structure, and vibrational assignment of bis(3,5-heptanedionato)copper(II) (چکیده)
50 - Quantum chemical study of the mechanism of the palladium-catalysed C−H acetoxylation of benzene (چکیده)
51 - The theoretical conceptual investigation of intramolecular hydrogen bond strength in the O-H…O=C systems (چکیده)
52 - Estimating the intramolecular hydrogen bonds strength in the O-H…O=C systems using experimental 1H NMR results and QTAIM calculations (چکیده)
53 - Molecular structure and intramolecular hydrogen bond strength of 3-methyl-4-amino-3-penten-2-one and its NMe and N-Ph substitutions by experimental and theoretical methods (چکیده)
54 - DFT studies on the Structure and metal-ligand bond strength in bis (trifluoroacetylacetonato)copper (II (چکیده)
55 - The I–V Characteristics of acetylacetone Nano-Molecular Wire Induced by Hydrogen Transfer (چکیده)
56 - Application of Hammett equation to intramolecular hydrogen bond strength in para-substituted phenyl ring of trifluorobenzoylacetone and 1-aryl-1,3-diketone malonates (چکیده)
57 - Structure and vibrational analysis of copper (II) heptane-3,5-dione (چکیده)
58 - The I–V Characteristics of dimethyl 3,5-heptane Nano-Molecular Wire Induced by Hydrogen Transfer (چکیده)
59 - Tautomeric Equilibria Studies by UV-Vis Spectroscopy in β-diketones (چکیده)
60 - Application of Hammett equation to intramolecular hydrogen bond strength in para-substituted phenyl ring in some β-diketones and schiff bases (چکیده)
61 - DFT studies on the structure and intramolecular hydrogen bond strength in 1, 2-dibenzoylcyclopentadiene (چکیده)
62 - Conformational stability, molecular structure, and intramolecular hydrogen bond of 2,2-dimethyl-5-amino-4-hexen-3-one (چکیده)
63 - Intramolecular hydrogen bond strength of 3-methyl-4-amino-3-penten-2-one, an experimental approach (چکیده)
64 - Tautomerism, molecular structure, intramolecular hydrogen bond, and tautomery equilibrium of α-methyl and ethyl substituted 4-amino-3-penten-2-one; A theoretical study (چکیده)
65 - Current–Voltage Characteristics of the Aziridine-Based Nano-Molecular Wires: a Light-Driven Molecular Switch (چکیده)
66 - Molecular structure, spectroscopic studies, and coppereoxygen bond strength of a-methyl and a-ethyl derivatives of copper (II) acetylacetonate; Experimental and theoretical approach (چکیده)
67 - Vibrational spectra, normal coordinate analysis, and hydrogen bond investigation of pyridinium perchlorate (چکیده)
68 - Correlation Between Parameters Related to Intramolecular Hydrogen Bond Strength and Hammett Constant in Para Substituted Benzoylacetone (A Theoretical and Experimental Study) (چکیده)
69 - تاتومری و قدرت پیوند هیدروژنی درون مولکولی پارا کلر بنزوئیل استون بوسیله محاسبات کوانتومی - و نتایج طیف سنجی (چکیده)
70 - Conventional and Unconventional Intramolecular Hydrogen Bonding in some Beta-diketones (چکیده)
71 - Tautomerism, molecular structure, intramolecular hydrogen bond, and enol-enol equilibrium of para halo substituted 4,4,4-trifluoro-1- phenyl-1,3-butanedione; Experimental and theoretical studies (چکیده)
72 - Vibrational assignment and the effect of -methyl and ethyl substitutions on the Cu-O strength in bis-(3-alkylpentane-2,4-dionato)copper(II); An experimental and DFT study (چکیده)
73 - Normal coordinate analysis of pyridine and its C2v 2H-isotopomers. A new approach (چکیده)
74 - Structure, isomerism, and vibrational assignment of aluminumtrifluoroacetylacetonate. An experimental and theoretical study (چکیده)
75 - Intramolecular hydrogen bond strength in three stable conformers of 2-(((1-phenylethyl) imino) methyl)phenol and itshalogen substitutions, as a Schiff base with chiral carbon; A theoretical study (چکیده)
76 - Conformational analysis of 2-(((1-phenylethyl)imino)methyl)phenol and its halogen substitutions, as a Schiff base with chiral carbon, A DFT study (چکیده)
77 - A first-principles study of aryloxyanthraquinone-based optical molecular switch (چکیده)
78 - Structure, vibrational analysisi and intramolecular hydrogen bond strength of some 4-amino-3-penten-2-one derivatives (چکیده)
79 - Structure and geometry of Tetrakis(thiourea) platinum(II) and its guanine substituted complexes, Anticancer compounds (چکیده)
80 - Conformational stability, and intramolecular hydrogen bonding of Ribose; A DFT calculations (چکیده)
81 - The Cu-O strength of Copper (II) X-benzoylacetonate, X=Cland F; by DFT calculations (چکیده)
82 - ارزیابی غیرمخرب ترکیبات شیمیایی چوب های مورد استفاده در بناهای تاریخی منطقه گرگان با استفاده از طیف سنجیFT-IR (چکیده)
83 - Conformational Analysis and Intramolecular Hydrogen Bonding in 4-Butylmino-3-Penten-2-One (چکیده)
84 - Structure and hydrogen bond strength of the enol form of Furoylacethylacetone (چکیده)
85 - Tautomerization and intramolecular hydrogen bond strength of 1-(4- Chlorophenyl)-4,4,4-trifluorobutane-1,3-dione by quantum calculations and experimental spectroscopy (چکیده)
86 - The effect of different Substitutions on the equilibrium constant of 1-Phenyl-1,3- butanedione (چکیده)
87 - Synthesis, Spectroscopic Investigations, and Computational Study of 4-((9,10-dioxo-9,10-dihydroanthracen-1-yl)oxy)-3- methoxybenzaldehyde1 (چکیده)
88 - کاربرد طیف سنجی ارتعاشی (Raman-Mid IR) در شناسایی گونه های سوزنی برگ و پهنبرگ (چکیده)
89 - ICT در آموزش (درس شیمی و آزمایشگاه) (چکیده)
90 - Molecular structure, spectroscopic investigations and computational study on the potential molecular switch of (E)-1-(4-(2- hydroxybenzylideneamino)phenyl)ethanone (چکیده)
91 - Synthesis, characterization, crystal structure determination and computational study of a new Cu(II) complex of bis [2-{(E)-[2- chloroethyl)imino]methyl}phenolato)] copper(II) Schiff base complex (چکیده)
92 - (Vibrational spectra, normal coordinate analysis, and conformation of bis(a-cyanoacetylacetonato) Cu(II (چکیده)
93 - Isomerism and Hydrogen Bonding in the Cis-enol Forms of 1-(n-pyridyl)butane-1,3-diones: A Theoretical Study (چکیده)
94 - CONFORMATIONAL ANALYSIS AND INTRAMOLECULAR HYDROGEN BONDING IN HEPTANE-3-AMINO-5-ONE (چکیده)
95 - PROTON TUNNELING IN PYRIDINE-PYRIDININIUM AND ITS 2-AMINO AND 2-AMINO-4-METHYL DERIVATIVES COMPLEXES (چکیده)
96 - NORMAL COORDINATE ANALYSIS AND VIBRATIONAL ASSIGNMENTS FOR PYRIDINE AND ITS DEUTERATED DERIVATIVES (چکیده)
97 - Study of the intramolecular hydrogen bonding of some α-cyano-1,3–diketones by using AIM and NBO calculations (چکیده)
98 - Theoretical investigation of 1,3-Di(n-pyridyl)-1,3-propanediones (چکیده)
99 - The effect of unconventional hydrogen bonding in the stability of keto forms of 2-Bromo-1,3-diphenylpropane-1,3-dione (چکیده)
100 - Tautomeric stability, molecular structure, NBO, electronic and NMR analyses of salicylideneimino-ethylimino-pentan-2-one (چکیده)
101 - Proton transfer in acetylacetone and its alpha-halo derivatives (چکیده)
102 - Normal coordinate analysis, hydrogen bonding, and conformation analysis of heptane-3,5-dione (چکیده)
103 - Vibrational spectra of a-bromo and a-chloro derivatives of tris(acetylacetonato)chromium(III (چکیده)
104 - Tautomerization in the some of α-bromo-β-Diketones (چکیده)
105 - Vibrational spectra of tris(acetylacetonato)chromium(III) (چکیده)
106 - The effect of bromination and media on the hydrogen bond strength of pyridinium perchlorate (چکیده)
107 - Nature of substituent effects on intramolecular hydrogen bonding of 3-amino-1- phenyl-2-buten-1-one derivatives by density functional theory (DFT) calculations and NMR spectroscopy (چکیده)
108 - Theoretical and spectroscopic study on intramolecular hydrogen bonding of 4- amino-3-penten-2-one derivatives (چکیده)
109 - Synthesis, spectroscopic investigations and computational study of monomeric and dimeric structures of 2-methyl-4-quinolinol (چکیده)
110 - Tautomerism, conformational analysis, and spectroscopy studies of 3-bromo-pentane-2,4-dione (چکیده)
111 - A new copper(II) Schiff base complex containing asymmetrical tetradentate N2O2 Schiff base ligand: Synthesis, characterization, crystal structure and DFT study (چکیده)
112 - Synthesis, molecular structure, spectroscopic investigations and computational studies of (E)-1-(4-(4-(diethylamino)-2- hydroxybenzylideneamino)phenyl)ethanone (چکیده)
113 - Adsorption of CCl4 on Armchair Single-Walled Carbon Nanotubes and Graphene Sheet (چکیده)
114 - Conformation, molecular structure, and vibrational assignment of bis(2,2,6,6-tetramethylheptane-3,5-dionato)copper(II) (چکیده)
115 - N-bromosuccinimide (NBS)-promoted, threecomponent synthesis of a,b-unsaturated isoxazol-5(4H)- ones, and spectroscopic investigation and computational study of 3-methyl-4-(thiophen-2-ylmethylene)isoxazol- 5(4H)-one (چکیده)
116 - Vibrational spectra of Ocimum basilicum L. seed gum (چکیده)
117 - Intramolecular hydrogen bonding and vibrational assignment of 1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedione (چکیده)
118 - Vibrational assignment of calcium acetylacetonate (چکیده)
119 - Very strong intramolecular hydrogen bonding of 1,2-dithenoylcyclopentadiene; DFT and spectroscopic studies (چکیده)
120 - Synthesis, characterization, crystal structure determination, computational study, and thermal decomposition into NiO nano-particles of a new NiIIL2 Schiff base complex (L = 2-{(E)-[2-chloroethyl)imino]methylphenolate) (چکیده)
121 - Theoretical study, and infrared and Raman spectra of copper(II) chelated complex with dibenzoylmethane (چکیده)
122 - Vibrational assignment and structure of Vanadyl acetoacetonate (چکیده)
123 - Molecular Structure and Intramolecular hydrogen bonding of 4-phenyliamino-3-penten-2-one and its para substitutions (چکیده)
124 - ﻣﻄﺎﻟﻌﺎت ﻧﻈﺮی روی اﺛﺮ ﺟﺎﻧﺸﯿﻨﯽ ﻫﺎﻟﻮژن در ﻣﻮﻗﻌﯿﺖ آﻟﻔﺎی ﺗﺮﮐﯿﺐ1و1و1-ﺗﺮیﻓﻠﻮرو-5و5-دیﻣﺘﯿﻞ- 2و4-ﻫﮕﺰان دی اُن (چکیده)
125 - The effect of phenyl substitutions on the structure and metal- ligand bond strength of copper acetylacetonate. A DFT study. (چکیده)
126 - بررسی ساختارو وقذرت پیونذ فلز با لیگانذ کمپلکس آلومینیوم تری فلوئورو استیل استونات با استفاده از نظریه DFT (چکیده)
127 - بررسی ساختار وطیف ارتعاشی نظری مس (II)دی بنزوئیل متان با استفاده ازنظریه تابعی چگال (چکیده)
128 - Conformational analysis and intramolecular hydrogen bond strength of methyl 3-aminocrotonate (چکیده)
129 - N-Bromosuccinimide or 1,3-di(chloro or bromo)-5,5-dimethylhydantoin: as a mild and efficient catalyst for the synthesis of 2-arylbenzothiazoles and 2,4,5-triaryl-lH-imidazoles from aromatic aldehydes (چکیده)
130 - Comparision the intramolecular hydrogen bond of BA and DBM with AA. (چکیده)
131 - Effect of t-butyl substitutions in β position on the enol-keto equilibrium and intramolecular hydrogen bond strength of β-dicarbonyl: A vibrational spectroscopy and DFT study (چکیده)
132 - The structure study of 1,3-diaryl-3H-benzo[f]chromenes (چکیده)
133 - Structure And Vibrational Analysis Of Ethyl 3-Amino-2-Butenoate (چکیده)
134 - Metal-Ligand Bond Vibrations In Alkaline Earth Metal Acetylacetonates (چکیده)
135 - Formation constant calculations comparison with experimental researches on ferrocene-containing β-diketones (چکیده)
136 - Molecular structure and intramolecular hydrogen bonding of 1,1,1- trifluoro-5,5-dimethyl-2,4-hexanedione. A DFT study (Part I) (چکیده)
137 - Molecular structure and intramolecular hydrogen bonding of Heptane-3,5-dione. A DFT study (چکیده)
138 - Structure and vibrational assignment of bis(benzoylacetone)copper(II) (چکیده)
139 - Structure of 2,4,5-triphenyl-1H-Imidazole and the substitution effect of F, Cl, and OH groups in para position of 2-Ph ring; A DFT study (چکیده)
140 - Cis-enol conformers and intramolecular hydrogen bond strength of 2,6-Dimethyl-3,5-heptanedione (چکیده)
141 - Conformation, Structure, Intramolecular H-bonding, and Vibrational Assignment of 1-(2-thienyl)-4,4,4-trifluorobutane-1,3-dione (چکیده)
142 - Cis-enol conformational stability, Molecular structure, and intramolecular hydrogen bonding of 5,5-Dimethyl hexane-2,4 dione. A density functional theoretical study (چکیده)
143 - Intramolecular hydrogen bonding and vibrational spectra of 2,2,6,6-tetramethyl-3,5-heptanedione (چکیده)
144 - INTRAMOLECULAR HYDROGEN BONDING AND KETO CONTENT IN α-HALO SUBSTITUTED 1,1,1-TRIFLUORO -5,5-DIMETHYL-2,4-HEXANDIONE (چکیده)
145 - KETO CONTENT AND INTRAMOLECULAR HYDROGEN BOND IN SOME β-DICARBONYLS (چکیده)
146 - Molecular Structure, and Intramolecular Hydrogen Bonding of Thenoyltrifluoroacetone (چکیده)
147 - Vibrational assignment and structure of trifluorobenzoylacetone: A density functional theoretical study (چکیده)
148 - A facile one-pot synthesis of functionalized fused benzochromene derivatives via intramolecular Wittig reactions (چکیده)
149 - Caesium iodide as an efficient catalyst for synthesis of N‑substituted azepines via tandem Michael addition and cyclisation under aqueous conditions (چکیده)
150 - Structure and vibrational assignment of bis(benzoylacetonato)copper(II) (چکیده)
151 - Structure and isomeric studies of 1,3-diaryl-H-benzo[f]chromene, catalyst effect or thermodynamic stability? An ab initio study (چکیده)
152 - Conformation, molecular structure, and intramolecular hydrogen bonding of 1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedione (چکیده)
153 - Vibrational assignment and structure of N-phenylthiobenzamide - A DFT approach (چکیده)
154 - Conformational analysis, intramolecular hydrogen bonding, and vibrational assignment of 4,4-dimethyl-1-phenylpentane-1,3-dione (چکیده)
155 - Theoretical and spectroscopic studies on molecular structure and hydrogen bonding of 1,2-bis (monochloroacetyl) cyclopentadiene (چکیده)
156 - The formation constants determination of α-formyl acetylacetonate complex by pH-metric titration (چکیده)
157 - The theoretical and experimental 1H NMR study of some beta-diketones (A DFT calculation (چکیده)
158 - Synthesis, structure, UV-visible spectrum, and formation constant of bis (3-amino-1-phenyl-2-buten-1-onato)copper (II) and comparison with bis (4-aminopent-3-en-2-onato) copper (II (چکیده)
159 - Structure and vibrational analysis of methyl 3-amino-2-butenoate (چکیده)
160 - Structure, vibrational assignment, and NMR spectroscopy of 1,2-bis (dichloroacetyl) cyclopentadiene (چکیده)
161 - Silica supported Fe(HSO4)3 as an efficient, heterogeneous and recyclable catalyst for synthesis of -enaminones and -enamino esters (چکیده)
162 - اثر استخلاف CF3 در موقعیت β بر قدرت پیوند هیدروژنی درون مولکولی β- دی کتون ها به کمک نظریه تابعی چگال (DFT) (چکیده)
163 - Intramolecular hydrogen bonding of 1,1,1-trifluoro-5,5-dimethyl-2,4- hexanedione. A vibrational spectroscopic study (Part II) (چکیده)
164 - Resonance assisted intramolecular hydrogen bonding of 6-hydroxy-6-(2-thienyl)-2-thenoylfulvene (چکیده)
165 - Structure and vibrational spectra of methyl 3-(methylamino)-2-Butenoate. A density functional theoretical study (چکیده)
166 - IR and Raman spectrophotometric studies on the effects of pH and temperature on structural stability of human serum albumin(HSA) (چکیده)
167 - Structure and conformation of lidocaine and Prilocaine. A DFT study (چکیده)
168 - اثر استخلاف گروه فنیل در موقعیت β بر قدرت پیوند هیدروژنی درون مولکولی β دی کتون ها به کمک نظریه تابعی چگال (DFT) (چکیده)
169 - Conformational stability, molecular structure, intramolecular hydrogen bonding, and vibrational spectra of 5,5-dimethylhexane-2,4-dione (چکیده)
170 - Efficient one-pot synthesis of 1,3-diaryl-3H-benzo[f]chromenes using ferric hydrogensulfate (چکیده)
171 - Structure, intramolecular hydrogen bonding, and vibrational spectraof 2,2,6,6-tetramethyl-3,5-heptanedione (چکیده)
172 - Conformation and vibrational spectra and assignment of 2-thenoyltrifluoroacetone (چکیده)
173 - Vibrational assignment and structure of benzoylacetone: A density functional theoretical study (چکیده)
