Quantitative structure activity relationships of some pyridine derivatives as corrosion inhibitors of steel in acidic medium

Journal of Molecular Modeling

Volumn 18, Issue 3, 2012, Pages 1173-1188

  El Ashry, El Sayed H ^a   El Nemr, Ahmed ^b   Ragab, Safaa ^a  

^a Alexandria University Faculty Of Science   (Egypt)

^b NATIONAL INSTITUTE OF OCEANOGRAPHY AND FISHERIES   (Egypt)

Author keywords

AM1; B3LYP; Corrosion inhibition; DFT; Linear solvation energy; Pyridine derivatives

Indexed keywords

ACID; PYRIDINE DERIVATIVE; STEEL;

ARTICLE; CORROSION; POLARIZATION; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM CHEMISTRY; SOLVATION;

ACIDS; CORROSION; PYRIDINES; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; STEEL;

EID: 84861334297     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-011-1148-7     Document Type: Article

References (89)

1. Eddy NO, Ebenso EE, El Nemr A, El Ashry ESH (2009) J Mol Model 15:1085-1092
2. El Ashry ESH, El Nemr A, Essawy SA, Ragab S (2006) Electrochim Acta 51:3957-3968
3. El Ashry ESH, El Nemr A, Essawy SA, Ragab S (2006) Chem Phys An Ind J 1:41-62
4. El Ashry ESH, El Nemr A, Essawy SA, Ragab S (2006) ARKIVOC 11:205-220
5. El Ashry ESH, El Nemr A, Essawy SA, Ragab S (2008) Prog Org Coat 61:11-20
6. Khamis E, Bellucci F, Latanision RM, El Ashry ESH (1991) Corros 47:677-672
7. Khamis E, El Ashry ESH, Ibrahim AK (2000) Brit Corros J 35:150-154
8. Schweinsberg DP, Ashworth V (1988) Corros Sci 28:539-545
9. Raicheva SN, Aleksiev BV, Sokolova EI (1993) Corros Sci 34:343-350
10. Cheng XL, Ma HY, Chen SH, Yu R, Chen X, Yao ZM (1998) Corros Sci 41:321-333
11. Quraishi MA, Khan MAW, Jamal D, Ajmal M, Muralidharan S, Iyer SVK (1996) J Appl Electrochem 26:1253-1258
12. Quraishi MA, Khan MAW, Jamal D, Ajmal M, Muralidharan S, Iyer SVK (1997) Brit Corros J 32:72-81
13. Mernari B, Attari HE, Traisnel M, Bentiss F, Lagrenée M (1998) Corros Sci 40:391-399
14. Hluchan V, Wheeler BL, Hackerman N (1988) Werkst Korros 39:512
15. Bouayed M, Rabaa H, Schiri A, Saillard JY, Ben Bachir A, Le Beuze A (1998) Corros Sci 41:501-517
16. El Azhar M, Mernari B, Traisnel M, Gengembre L, Bentiss F, Lagrenée M (2001) Corros Sci 43:2229-2238
17. Bentiss F, Traisnel M, Lagrenée M (2001) J Appl Electrochem 31:41-48
18. Wang L, Yin GJ, Yin G (2001) Corros Sci 43:1197-1202
19. Quraishi MA, Khan MAW, Ajmal M, Muralidharan S (1995) Port Electrochim Acta 13:63-71
20. Quraishi MA, Khan MAW, Ajmal M, Muralidharan S, Iyer SVK (1997) Corros 53:475-481
21. Quraishi MA, Khan MAW, Ajmal M (1996) Methods Mater 43:5-8
22. Quraishi MA, Sardar R (2002) Mater Chem Phys 78:425-431
23. Stupnišek-Lisac E, Podbršcek S, Soric T (1994) J Appl Electrochem 24:779-784
24. Touhami F, Aouniti A, Abed Y, Hammouti B, Kertit S, Ramdani A, Elkacemi K (2000) Corros Sci 42:929-940
25. Tang L, Li X, Li L, Mu G, Liu G (2006) Coat Technol 201:384-388
26. Hosseini M, Mertens SFL, Ghorbani M, Arshadi MR (2003) Mater Chem Phys 78:800-808
27. Subramanyam NC, Sheshardi BS, Mayanna SA (1993) Corros Sci 34:563-571
28. Domenicano A, Hargittai I (1992) Accurate molecular structures, their determination and importance. Oxford University Press, New York
29. Kraka E, Cremer D (2000) J Am Chem Soc 122:8245-8264
30. Bentiss F, Traisnel M, Vezin H, Lagrenée M (2003) Corros Sci 45:371-380
31. Martinez S, Stagljar I (2003) J Mol Struct THEOCHEM 640:167-174
32. Emreguel KC, Hayvali M (2006) Corros Sci 48:797-812
33. Yurt A, Bereket G, Kivrak A, Balaban A, Erk B (2005) J Appl Electrochem 35:1025-1032
34. Emreguel KC, Abduelkadir AA, Atakol O (2005) Mater Chem Phys 93:325-329
35. Talati JD, Desai MN, Shah NK (2005) Anti-Corros Methods Mater 52:108-117
36. Baghaei F, Sheikhshoaie I, Dadgarnezhad A (2005) Asian J Chem 17:224-232
37. Aytac A, Oezmen U, Kabasakaloglu M (2005) Mater Chem Phys 89:176-181
38. Dadgarnezhad A, Sheikhshoaie I, Baghaei F (2004) Asian J Chem 16:1109-1116
39. Dadgarnezhad A, Sheikhshoaie I, Baghaei F (2004) Anti-Corros Methods Mater 51:266-273
40. Yurt A, Balaban A, Kandemir SU, Bereket G, Erk B (2004) Mater Chem Phys 85:420-426
41. Emregul KC, Atakol O (2004) Mater Chem Phys 83:373-379
42. Sudha P, Menaka S, Elango KP (2004) Trans SAEST 39:17-21
43. Emregul KC, Kurtaran R, Atakol O (2003) Corros Sci 45:2803-2817
44. Emregul KC, Atakol O (2003) Mater Chem Phys 82:188-193
45. Bilgic S, Caliskan N (2001) J Appl Electrochem 31:79-83
46. Grigorev VP, Shpanko SP, Nassar AF, Dymnikova OV (2000) Russ J Electrochem (Translation of Elektrokhimiya) 36:1157-1162
47. Shokry H, Sekine I, Yuasa M et al. (1998) Zairyo to Kankyo:47-451
48. Donya AP, Bratchun VI, Pakter MK, Shalimova MA (1997) Prot Metals (Translation of Zashchita Metallov) 33:377-381
49. Quraishi MA, Ajmal M, Shere S (1996) Bull Electrochem 12:523-527
50. Mohamed AK, Bekheit MM, Fouda AS (1991) Bulletin de la Societe Chimique de France (May-June) 331-340
51. Desai MN, Desai MB, Shah CB, Desai SM (1986) Corros Sci 26:827-837
52. Cruz J, Martíinez R, Genesca J, García-Ochoa E (2004) J Electroanal Chem 566:111-121
53. Gece G, Bilgiç S (2009) Corros Sci 51:1876-1878
54. Jamalizadeh E, Hosseini SMA, Jafari AH (2009) Corros Sci 51:1428-1435
55. Arslan T, Kandemirli F, Ebenso EE, Love I, Alemu H (2009) Corros Sci 51:35-47
56. Jamalizadeh E, Jafari AH, Hosseini SMA (2008) J Mol Struct THEOCHEM 870:23-30
57. Yana Y, Li W, Caia L, Houb B (2008) 2008. Electrochim Acta 53:5953-5960
58. Roque JM, Pandiyan T, Cruz J, García-Ochoa E (2008) Corros Sci 50:614-624
59. Ju H, Kai ZP, Li Y (2008) Corros Sci 50:865-871
60. Lebrini M, Lagrenée M, Vezin H, Traisnel M, Bentiss F (2007) Corros Sci 49:2254-2269
61. Tang Y, Yang X, Yang W, Chen Y, Wan R (2010) Corros Sci 52:242-249
62. Bereket G, Öǧretir C, Özşahin Ç (2003) Quantum chemical studies on the inhibition efficiencies of some piperazine derivatives for the corrosion of steel in acidic medium. J Mol Struct THEOCHEM 663:39-46
63. Kandemirli F, Sagdinc S (2007) Corros Sci 49:2118-2130
64. Zhang SG, Lei W, Xia MZ, Wang FY (2005) J Mol Struct THEOCHEM 732:173-182
65. Gece G (2008) Corros Sci 50:2981-2992
66. Karelson M, Lobanov V (1996) Chem Rev 96:1027-1043
67. Hinchliffe A (1994) Modelling Molecular Structures. John Wiley & Sons, New York
68. Hinchliffe A (1999) Chemical Modelling From Atoms to Liquids. Wiley, New York
69. CS Chemoffice Pro for Microsoft Windows, Cambridge Scientific Computing Inc, 875 Massachusetts Avenue, Suite 61, Cambridge MA 2139, USA
70. Hickey JP, Passino-Reader DR (1991) Environ Sci Technol 25:1753-1760
71. Bouklah M, Ouassini A, Hammouti B, El Idrissi A (2005) Appl Surf Sci 250:50-56
72. Abd El-Maksoud SA, Fouda AS (2005) Mater Chem Phys 93:84-90
73. Tang L, Li X, Li L, Mu G, Liu G (2006) Surf Coat Technol 201:384-388
74. Tang L, Li X, Li L, Qua Q, Mua G, Liu G (2005) Mater Chem Phys 94:353-359
75. Li X, Tang L, Li L, Mu G, Liu G (2006) Corros Sci 48:308-321
76. Bentiss F, Gassama F, Barbry D, Gengembre L, Vezin H, Lagrenee M, Traisnel M (2006) Appl Surf Sci 252:2684-2691
77. Lebrini M, Bentiss F, Vezin H, Lagrenee M (2005) Appl Surf Sci 252:950-958
78. Lukovits I, Kalman E, Zucchi F (2001) Corros 57:3-8
79. Sastri VS, Perumareddi JR (1997) Corros 53:617-622
80. Lukovits I, Palfi K, Bako I, Kalman E (1997) Corros 53:915-919
81. Li SL, Wang YG, Chen SH, Yu R, Lei SB, Ma HY, Liu DX (1999) Corros Sci 41:1769-1782
82. Bereket G, Hur E, Ogretir C (2002) J Mol Struct THEOCHEM 578:79-88
83. Fang J, Li J (2002) J Mol Struct THEOCHEM 593:179-184
84. Xiao-Ci Y, Hong Z, Ming-Dao L, Hong-Xuan R, Lu-An Y (2000) Corros Sci 42:645-653
85. Cruz J, Garcia-Ochoa E, Castro M (2003) J Electrochem Soc 150:B26
86. Khalil N (2003) Electrochim Acta 48:2635-2640
87. Khaled KF, Babic-Samardzija K, Hackerman N (2004) J Appl Electrochem 34:697-705
88. Khaled KF, Babic-Samardzija K, Hackerman N (2005) Electrochim Acta 50:2515-2520
89. Lukovits I, Kalman E, Palinkas G (1995) Corros 51:201-205