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متن کامل


اطلاعات دوره: 
  • سال: 

    2014
  • دوره: 

    21
تعامل: 
  • بازدید: 

    137
  • دانلود: 

    0
کلیدواژه: 
چکیده: 

AROMATICITY IS ONE OF THE CORNERSTONES OF MODERN ORGANIC CHEMISTRY, AROMATICITY IS A MANIFESTATION OF ELECTRON DELOCALIZATION IN CLOSED CIRCUITS, EITHER IN TWO OR IN THREE DIMENSIONS [1–2], THE MOLECULAR GEOMETRIES OF AROMATIC RINGS IN (SCHEME 1) HAVE BEEN FULLY OPTIMIZED AND THEIR WAVE FUNCTIONS HAVE BEEN USED TO CHARACTERIZE TOPOLOGICAL PROPERTIES OF THE ELECTRONIC CHARGE DENSITY. ...

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بازدید 137

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نویسنده: 

PAHLAVANZADEH HASSAN | BAKHSHI HAMID

اطلاعات دوره: 
  • سال: 

    2011
  • دوره: 

    7
تعامل: 
  • بازدید: 

    180
  • دانلود: 

    0
چکیده: 

THE SOLUBILITY OF ACRIDINE IN SUPERCRITICAL CARBON DIOXIDE WAS MEASURED AT TEMPERATURES 313, 323 AND 333 K AND IN THE PRESSURE RANGE OF 120 TO 350 BAR USING STATIC METHOD. THE CROSSOVER PRESSURE OF ACRIDINE WAS OBSERVED AT ABOUT 150 BAR. THE EXPERIMENTAL DATA WERE CORRELATED USING PENG- ROBINSON (PR) AND SOAVE- REDLICH- KWONG (SRK) EQUATIONS OF STATE (EOS) AND VAN DER WAALS MIXING RULE. THE BINARY INTERACTION PARAMETERS OF THE MODELS WERE REPORTED. THE RESULTS OF AVERAGE ABSOLUTE RELATIVE DEVIATIONS (AARD) ILLUSTRATED GOOD ACCURACY OF THE STUDIED MODELS. THE RESULTS ALSO SHOWED THAT, AMONG THE STUDIED MODELS, PR- VDW 2 MODEL HAS THE MINIMUM AARD (5.08 %).

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نویسندگان: 

KOSOWER N.S. | KATAYOSE H. | YANAGIMACHI R.

نشریه: 

JOURNAL OF ANDROLOGY

اطلاعات دوره: 
  • سال: 

    1992
  • دوره: 

    13
  • شماره: 

    -
  • صفحات: 

    342-348
تعامل: 
  • استنادات: 

    1
  • بازدید: 

    150
  • دانلود: 

    0
کلیدواژه: 
چکیده: 

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بازدید 150

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نویسندگان: 

GHORBANI VAGHEI R. | MALAEKEHPOUR S.M.

اطلاعات دوره: 
  • سال: 

    2010
  • دوره: 

    7
  • شماره: 

    4
  • صفحات: 

    957-964
تعامل: 
  • استنادات: 

    0
  • بازدید: 

    467
  • دانلود: 

    0
چکیده: 

N, N' -Dibromo- N, N' -1, 2-ethanediyl bis (p-toluene sulfonamide) [BNBTS] as a reusable catalyst promoted one-pot synthesis of benzo [c] acridines in good to high yields under three-component reaction from anilines, aldehydes and cyclic 1, 3-dicarbonyl compounds under solvent-free conditions.

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بازدید 467

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نویسندگان: 

SUKCHAROEN N.

اطلاعات دوره: 
  • سال: 

    1995
  • دوره: 

    78
  • شماره: 

    -
  • صفحات: 

    82-87
تعامل: 
  • استنادات: 

    1
  • بازدید: 

    150
  • دانلود: 

    0
کلیدواژه: 
چکیده: 

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بازدید 150

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اطلاعات دوره: 
  • سال: 

    2013
  • دوره: 

    20
تعامل: 
  • بازدید: 

    134
  • دانلود: 

    0
کلیدواژه: 
چکیده: 

THE REACTION OF 9, 10-DIHYDROACRIDINES WITH THE OXALYL CHLORIDE GENERATED AMIDE-ACID CHLORIDES WHICH WERE CONVERTED TO 1, 2 DICARBONYL COMPOUNDS BY ALUMINUM CHLORIDE [1]. IN THIS STUDY WE REPORTED THE SYNTHESIS OF 9, 9-DIMETHYL-9, 10–DIHYDROACRIDINE (V) BY THE REACTION OF 2- (2-CHLOROPHENYL) PROPAN-2-OL (III) AND ANILINE IN GOOD YIELD...

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بازدید 134

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نویسندگان: 

BELMONT P. | BOSSON J.

اطلاعات دوره: 
  • سال: 

    2007
  • دوره: 

    7
  • شماره: 

    -
  • صفحات: 

    0-0
تعامل: 
  • استنادات: 

    1
  • بازدید: 

    247
  • دانلود: 

    0
کلیدواژه: 
چکیده: 

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بازدید 247

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نویسنده: 

SAMIMI M. | DEHESTANI M.

اطلاعات دوره: 
  • سال: 

    2013
  • دوره: 

    16
تعامل: 
  • بازدید: 

    144
  • دانلود: 

    0
چکیده: 

A THEORETICAL METHOD TO CALCULATE MULTIDIMENSIONAL FRANCK–CONDON FACTORS IS DESCRIBED AND USED TO SIMULATE THE PHOTOELECTRON SPECTRUM OF THE ANION ACRIDINE (AD-). NEGATIVE ION PHOTOELECTRON SPECTROSCOPY WAS EMPLOYED TO INVESTIGATE THE ELECTRONIC STRUCTURE OF THE ACRIDINE MOLECULAR ANION AND ITS MONOHYDRATED ANION IN THE GAS PHASE. GEOMETRY OPTIMIZATIONS AND HARMONIC VIBRATIONAL FREQUENCY CALCULATIONS HAVE BEEN PERFORMED ON THE X1A1 STATE OF AD AND X2A1 STATE OF AD- ARE OBTAINED BY EMPLOYING AN ITERATIVE FRANCK–CONDON ANALYSIS PROCEDURE IN THE SPECTRAL SIMULATIONS.

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بازدید 144

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اطلاعات دوره: 
  • سال: 

    621
  • دوره: 

    44
  • شماره: 

    4
  • صفحات: 

    1021-1032
تعامل: 
  • استنادات: 

    0
  • بازدید: 

    10
  • دانلود: 

    0
چکیده: 

The ongoing endeavor to synthesize new antibacterial compounds is essential in overcoming bacterial resistance, as this poses a serious threat to the survival of the human race. This research work aimed to synthesize new amide derivatives of fused imidazole and acridines due to their high potential and remarkable biological history. To accomplish this objective, various derivatives of 3H-imidazo[4,5-a] acridines were prepared and then transformed into new amide derivatives under acidic conditions. The novel compounds were characterized based on spectral analysis, including FT-IR, 1H NMR, and 13C NMR spectra, along with additional analytical data. Antibacterial testing was conducted on the compounds, assessing their activity against a variety of bacterial strains, encompassing both gram-negative and gram-positive species. Minimum Inhibitory Concentration (MIC) values were recorded. The findings of the antimicrobial screening tests demonstrated that the compounds exhibit a high level of efficacy against both bacterial strains. Their Minimum Inhibitory Concentration (MIC) values are similar to well-known antibacterial agents such as Ciprofloxacin. Additionally, the compounds exhibited cytostatic properties in the higher micromolar range. By utilizing the molecular docking method, the binding sites of compounds with the dihydrofolate reductase enzyme were determined.

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اطلاعات دوره: 
  • سال: 

    2024
  • دوره: 

    7
  • شماره: 

    4
  • صفحات: 

    453-471
تعامل: 
  • استنادات: 

    0
  • بازدید: 

    5
  • دانلود: 

    0
چکیده: 

This study assesses the corrosion inhibition effectiveness of Acridine and its derivatives Acridine -ACD, Acridine-2-Carboxylic Acid-ACA, Acridine-2-Carbaldehyde-A2C, and 2-Ethyl –Acridine -2EA on Al (110) surfaces using quantum chemical analysis. Computational chemistry techniques were employed to calculate the binding energies of these inhibitors, which were found to be -39.918 kcal/mol for ACD, -53.042 kcal/mol for ACA, -47.001 kcal/mol for A2C, and -46.319 kcal/mol for 2EA. Besides binding energies, various Fukui functions and energy parameters were analysed, including EHOMO (The Highest Occupied Molecular Orbital Energy), ELUMO (The Lowest Unoccupied Molecular Orbital Energy), ΔE (Energy Gap), ΔNAl (Charge Transfer to the Aluminum Surface), ω (Stability Index), and ΔE_b-d (Binding Energy Difference). Among the tested inhibitors, ACA demonstrated the highest binding energy across all parameters, indicating the strongest interaction with the aluminum surface. The Fukui function study revealed that atoms C1, C13, N6, and N7 exhibited higher Fukui values for both Fukui (+) and Fukui (-), suggesting these atoms play a crucial role in the interaction with the aluminum surface. ACA's optimal electronic and binding properties enable it to form a robust protective layer on Al (110), significantly enhancing corrosion resistance. In conclusion, ACA emerged as the most effective corrosion inhibitor among the Acridine derivatives studied, providing superior protection for Al (110) surfaces.

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