The interconversion mechanism between TcO3+ and TcO2 + core of 99mTc labeled amine-oxime (AO) complexes

Theoretical Chemistry Accounts

Volumn 121, Issue 5-6, 2008, Pages 271-278

  Jia, Hong Mei ^a   Fang, De Cai ^a   Feng, Yan ^a   Zhang, Jian Ying ^a   Fan, Wen Bo ^a   Zhu, Lin ^a  

^a BEIJING NORMAL UNIVERSITY   (China)

Author keywords

99mTc HL91; B3LYP; Interconversion mechanism; TcO2 + core; TcO3+ core

Indexed keywords

EID: 84962385637     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-008-0474-z     Document Type: Article

References (43)

1. S Jurisson D Berning W Jia D Ma 1993 Chem Rev 93 1137 10.1021/cr00019a013
2. Archer CM, Edwards B, Kelly JD, King AC, Burke JF, Riley ALM (1995) In: Nicolini M, Bandoli G, Mazzi U (eds) Technetium and rhenium in chemistry and nuclear medicine. SGE Ditoriali, Padova, p 535
3. K Imahashi K Morishita H Kusuoka Y Yamamichi S Hasegawa K Hashimoto 2000 J Nucl Med 41 1102
4. DJ Honess SA Hill DR Collingridge R Edwards G Brauers NA Powell 1998 Int J Radiat Oncol Biol Phys 42 731 10.1016/S0360-3016(98)00300-9
5. X Zhang T Melo JR Ballinger AM Rauth 1998 Int J Radiat Oncol Biol Phys 42 737 10.1016/S0360-3016(98)00301-0
6. GJR Cook S Houston SF Barrington I Fogelman 1998 J Nucl Med 39 99
7. K Yutani H Kusuoka K Fukuchi M Tatsumi T Nishimura 1999 J Nucl Med 40 854
8. M Tatsumi K Yutani H Kusuoka T Nishimura 1999 Eur J Nucl Med 26 91 10.1007/s002590050364
9. CK Fair DE Troutner EO Schlemper RK Murmann ML Hoppe 1984 Acta Crystallogr C 40 1544 10.1107/S0108270184008647
10. S Jurisson EO Schlemper DE Troutner LR Canning DP Nowotnik RD Neirinckx 1986 Inorg Chem 25 543 10.1021/ic00224a031
11. PS Walker PM Bergin MC Grossel PN Horton 2004 Inorg Chem 43 4145 10.1021/ic0497634
12. S Jurisson K Aston CK Fair EO Schlemper PR Sharp DE Troutner 1987 Inorg Chem 26 3576 10.1021/ic00268a031
13. JE Cyr DP Nowotnik Y Pan JZ Gougoutas MF Malley JD Marco 2001 Inorg Chem 40 3555 10.1021/ic991381o
14. G Brauers CM Archer JF Burke 1997 Eur J Nucl Med 24 943
15. AD Becke 1993 J Chem Phys 98 5648 10.1063/1.464913
16. C Lee W Yang RG Parr 1988 Phys Rev B 37 785 10.1103/PhysRevB.37.785
17. Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR (2004) Gaussian, Inc., Wallingford CT, Gaussian 03, Revision C.02
18. RFW Bader 1991 Chem Rev 91 893 10.1021/cr00005a013
19. Bader RFW (1990) Atoms in molecules: a quatum theory. Clarendon Press, Oxford
20. N Godbout DR Salahub J Andzelm E Wimmer 1992 Can J Chem 70 560 10.1139/v92-079
21. PJ Hay WR Wadt 1985 J Chem Phys 82 299 10.1063/1.448975
22. K Ishida K Morokuma A Komornicki 1977 J Chem Phys 66 2153 10.1063/1.434152
23. C Gonzales HB Schlegel 1989 J Chem Phys 90 2154 10.1063/1.456010
24. C Gonzales HB Schlegel 1990 J Chem Phys 94 5523 10.1021/j100377a021
25. AP Scott L Radom 1996 J Phys Chem 100 16502 10.1021/jp960976r
26. Young D (2001) Computational chemistry, a practical guide for applying techniques to real world problems. Willey-Interscience, New York
27. S Miertus E Scrocco J Tomasi 1981 Chem Phys 55 117 10.1016/0301-0104(81) 85090-2
28. S Miertus J Tomasi 1982 Chem Phys 65 239 10.1016/0301-0104(82)85072-6
29. M Cossi V Barone R Cammi J Tomasi 1996 Chem Phys Lett 255 327 10.1016/0009-2614(96)00349-1
30. MT Cances V Mennucci J Tomasi 1997 J Chem Phys 107 3032 10.1063/1.474659
31. V Barone M Cossi B Mennucci J Tomasi 1997 J Chem Phys 107 3210 10.1063/1.474671
32. M Cossi V Barone J Tomasi 1998 Chem Phys Lett 286 253 10.1016/S0009-2614(98)00106-7
33. V Barone M Cossi 1998 J Phys Chem A 102 1995 10.1021/jp9716997
34. Bader RFW, Biegler-König FW, Cheeseman JR, Duke JA, Keith TA, Krug P et al (1994) AIMPAC (a set of programs for the theory of atoms in molecules). McMaster Univeristy, Hamilton
35. FW Biegler-König RFW Bader TH Tang 1982 J Comput Chem 3 317 10.1002/jcc.540030306
36. Fang DC, Tang TH (1998) AIM98PC (a modified PC version of AIMPAC). Beijing Normal University, Beijing
37. F Biegler-König J Schonbohm D Bayles 2001 J Comput Chem 22 545 10.1002/1096-987X(20010415)22:5<545::AID-JCC1027>3.0.CO;2-Y
38. F Biegler-König J Schonbohm 2002 J Comput Chem 23 1489 10.1002/jcc.10085
39. WJ Ding DC Fang 2001 J Org Chem 66 6673 10.1021/jo010461i
40. MJ Wei DC Fang RZ Liu 2002 J Org Chem 67 7432 10.1021/jo0258709
41. SY Yang CK Sun DC Fang 2002 J Org Chem 67 3841 10.1021/jo025575o
42. YQ Ding DC Fang 2003 J Org Chem 68 4382 10.1021/jo0340713
43. X Zhang T Melo AM Rauth JR Ballinger 2001 Nucl Med Biol 28 949 10.1016/S0969-8051(01)00267-0