152 related articles for article (PubMed ID: 16429476)
1. Density functional studies on the Nazarov reaction involving cyclic systems.
Cavalli A; Masetti M; Recanatini M; Prandi C; Guarna A; Occhiato EG
Chemistry; 2006 Mar; 12(10):2836-45. PubMed ID: 16429476
[TBL] [Abstract][Full Text] [Related]
2. Predicting reactivity and stereoselectivity in the Nazarov reaction: a combined computational and experimental study.
Cavalli A; Pacetti A; Recanatini M; Prandi C; Scarpi D; Occhiato EG
Chemistry; 2008; 14(30):9292-304. PubMed ID: 18752233
[TBL] [Abstract][Full Text] [Related]
3. New synthetic approach to cyclopenta-fused heterocycles based upon a mild nazarov reaction. 2. Further studies on the torquoselectivity.
Prandi C; Ferrali A; Guarna A; Venturello P; Occhiato EG
J Org Chem; 2004 Oct; 69(22):7705-9. PubMed ID: 15498000
[TBL] [Abstract][Full Text] [Related]
4. New synthetic approach to cyclopenta-fused heterocycles based upon a mild Nazarov reaction.
Occhiato EG; Prandi C; Ferrali A; Guarna A; Venturello P
J Org Chem; 2003 Dec; 68(25):9728-41. PubMed ID: 14656100
[TBL] [Abstract][Full Text] [Related]
5. Combined computational and experimental studies of the mechanism and scope of the retro-Nazarov reaction.
Harmata M; Schreiner PR; Lee DR; Kirchhoefer PL
J Am Chem Soc; 2004 Sep; 126(35):10954-7. PubMed ID: 15339180
[TBL] [Abstract][Full Text] [Related]
6. Mechanistic insights on the cycloisomerization of polyunsaturated precursors catalyzed by platinum and gold complexes.
Soriano E; Marco-Contelles J
Acc Chem Res; 2009 Aug; 42(8):1026-36. PubMed ID: 19480448
[TBL] [Abstract][Full Text] [Related]
7. Regio-, peri-, and torquoselectivity in hydroxy heptatrienyl cation electrocyclizations: the iso/homo-Nazarov reaction.
Nieto Faza O; Silva López C; Alvarez R; de Lera AR
Chemistry; 2009; 15(8):1944-56. PubMed ID: 19123209
[TBL] [Abstract][Full Text] [Related]
8. Theoretical study of the electrocyclic ring closure of hydroxypentadienyl cations.
Nieto Faza O; Silva López C; Alvarez R; de Lera AR
Chemistry; 2004 Sep; 10(17):4324-33. PubMed ID: 15352115
[TBL] [Abstract][Full Text] [Related]
9. New insights into the torquoselectivity of the Staudinger reaction.
Liang Y; Jiao L; Zhang S; Yu ZX; Xu J
J Am Chem Soc; 2009 Feb; 131(4):1542-9. PubMed ID: 19132931
[TBL] [Abstract][Full Text] [Related]
10. DFT study of the mechanisms of in water Au(I)-catalyzed tandem [3,3]-rearrangement/Nazarov reaction/[1,2]-hydrogen shift of enynyl acetates: a proton-transport catalysis strategy in the water-catalyzed [1,2]-hydrogen shift.
Shi FQ; Li X; Xia Y; Zhang L; Yu ZX
J Am Chem Soc; 2007 Dec; 129(50):15503-12. PubMed ID: 18027935
[TBL] [Abstract][Full Text] [Related]
11. DFT study on the mechanisms of stereoselective C2-vinylation of 1-substituted imidazoles with 3-phenyl-2-propynenitrile.
Wei D; Tang M
J Phys Chem A; 2009 Oct; 113(41):11035-41. PubMed ID: 19757851
[TBL] [Abstract][Full Text] [Related]
12. Are electrocyclization reactions of (3Z)-1,3,5-hexatrienone and nitrogen derivatives pseudopericyclic? A DFT study.
Cabaleiro-Lago EM; Rodríguez-Otero J; Varela-Varela SM; Peña-Gallego A; Hermida-Ramón JM
J Org Chem; 2005 May; 70(10):3921-8. PubMed ID: 15876080
[TBL] [Abstract][Full Text] [Related]
13. Progressive systematic underestimation of reaction energies by the B3LYP model as the number of C-C bonds increases: why organic chemists should use multiple DFT models for calculations involving polycarbon hydrocarbons.
Check CE; Gilbert TM
J Org Chem; 2005 Nov; 70(24):9828-34. PubMed ID: 16292812
[TBL] [Abstract][Full Text] [Related]
14. A comprehensive theoretical study on the coupling reaction mechanism of propylene oxide with carbon dioxide catalyzed by copper(I) cyanomethyl.
Guo CH; Wu HS; Zhang XM; Song JY; Zhang X
J Phys Chem A; 2009 Jun; 113(24):6710-23. PubMed ID: 19469523
[TBL] [Abstract][Full Text] [Related]
15. Oxidation of hydroxylamine by nitrous and nitric acids. Model development from first principle SCRF calculations.
Raman S; Ashcraft RW; Vial M; Klasky ML
J Phys Chem A; 2005 Sep; 109(38):8526-36. PubMed ID: 16834250
[TBL] [Abstract][Full Text] [Related]
16. DFT study of deNO(x) reactions in the gas phase: mimicking the reaction mechanism over BaNaY zeolites.
Sung CY; Snurr RQ; Broadbelt LJ
J Phys Chem A; 2009 Jun; 113(24):6730-9. PubMed ID: 19459611
[TBL] [Abstract][Full Text] [Related]
17. Reactions of F+(3P) and F+(1D) with silicon oxide. Possibility of spin-forbidden processes.
Trujillo C; Lamsabhi AM; Mó O; Yañez M
J Phys Chem A; 2006 Jun; 110(22):7130-7. PubMed ID: 16737263
[TBL] [Abstract][Full Text] [Related]
18. Interplay of structure and reactivity in a most unusual furan Diels-Alder reaction.
Griffith GA; Hillier IH; Moralee AC; Percy JM; Roig R; Vincent MA
J Am Chem Soc; 2006 Oct; 128(40):13130-41. PubMed ID: 17017793
[TBL] [Abstract][Full Text] [Related]
19. Characterization of ground and low-lying excited states of CoO4: a combined matrix isolation and DFT study.
Danset D; Alikhani ME; Manceron L
J Phys Chem A; 2005 Jan; 109(1):105-14. PubMed ID: 16839094
[TBL] [Abstract][Full Text] [Related]
20. Density functional theory for charge transfer: the nature of the N-bands of porphyrins and chlorophylls revealed through CAM-B3LYP, CASPT2, and SAC-CI calculations.
Cai ZL; Crossley MJ; Reimers JR; Kobayashi R; Amos RD
J Phys Chem B; 2006 Aug; 110(31):15624-32. PubMed ID: 16884287
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
