Stereoregularity of poly(lactic acid) and their model compounds as studied by NMR and quantum chemical calculations

Macromolecules

Volumn 44, Issue 23, 2011, Pages 9247-9253

  Suganuma, Koto ^a,b   Horiuchi, Ken ^b   Matsuda, Hironori ^b   Cheng, H N ^c   Aoki, Akihiro ^a   Asakura, Tetsuo ^a  

^a TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY   (Japan)

^b TEIJIN LTD   (Japan)

^c SOUTHERN REGIONAL RESEARCH CENTER   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CONFORMATIONAL ENERGIES; DIFFERENT SOLVENTS; DIMER MODEL; GAUSSIANS; INTERNAL ROTATIONS; ISOTACTICS; MODEL COMPOUND; NMR CHEMICAL SHIFTS; NMR PEAKS; NMR SPECTRUM; OCCURRENCE PROBABILITY; POLY(LACTIC ACID); QUANTUM CHEMICAL CALCULATIONS; SOLVENT EFFECTS; STEREOREGULARITY; SYNDIOTACTICS; TACTICITIES;

CHEMICAL SHIFT; DIMERS; DIMETHYL SULFOXIDE; LACTIC ACID; MONOMERS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; OPTIMIZATION; ORGANIC SOLVENTS; QUANTUM CHEMISTRY;

CONFORMATIONS;

EID: 82955206435     PISSN: 00249297     EISSN: None     Source Type: Journal    
DOI: 10.1021/ma2018777     Document Type: Article

References (37)

1. Okihara, T.; Tsuji, M.; Kawaguchi, A.; Katayama, K. J. Macromol. Sci. Phys. 1991, B30 (1&2) 119-140
2. Ikada, Y.; Jamshidi, K.; Tsuji, H.; Hyon, S.-H. Macromolecules 1987, 20, 904-906
3. Tsuji, H.; Ikada, Y. Macromolecules 1993, 26, 6918-6926
4. Tsuji, H.; Ikada, Y. Macromolecules 1992, 25, 5719-5723
5. Li, L.; Zhong, Z.; de Jeu, W. H.; Dijkstra, P. J.; Feijen, J. Macromolecules 2004, 37, 8641-8646
6. Tsuji, H.; Horii, F.; Nakagawa, M.; Ikada, Y.; Odani, H.; Kitamaru, R. Macromolecules 1992, 25, 4114-4118
7. He, Y.; Xu, Y.; Wei, J.; Fan, Z.; Li, S. Polymer 2008, 49, 5670-5675
8. Tsuji, H.; Ikada, Y. Macromol. Chem. Phys. 1996, 197, 3483-3499
9. Yui, N.; Dijikstra, P. J.; Feijen, J. Macromol. Chem. 1990, 191, 481-488
10. Fukushima, K.; Kimura, Y. Macromol. Symp. 2005, 224, 133-143
11. Fukushima, K.; Furuhashi, Y.; Sogo, K.; Miura, S.; Kimura, Y. Macromol. Biosci. 2005, 5, 21-29
12. Bero, M.; Kasperczyk, J.; Jedlinski, Z. J. Makromol. Chem. 1990, 191, 2287-2296
13. Kricheldorf, H. R.; Boettcher, C.; Tonnes, K. Polymer 1992, 33, 2817-2824
14. Kasperczyk, J. E. Macromolecules 1995, 28, 3937-3939
15. Thakur, K. A. M.; Kean, R. T.; Hall, E. S. Macromolecules 1997, 30, 2422-2428
16. Kasperczyk, J. E. Polymer 1999, 40, 5455-5458
17. Chisholm, M. H.; Iyer, S. S.; McCollum, D. G.; Pagel, M.; Werner-Zwanziger, U. Macromolecules 1999, 32, 963-973
18. Zell, M. T.; Padden, B. E.; Paterick, A. J.; Thakur, K. A. M.; Kean, R. T.; Hillmyer, M. A.; Munson, E. J. Macromolecules 2002, 35, 7700-7707
19. Tonelli, A. E. NMR Spectroscopy and polymer microstructure; VCH Publishers: New York, 1989.
20. Matsuzaki, K.; Uryu, T.; Asakura, T. NMR spectroscopy and stereoregularity of polymers; Japan Scientific Societies Press: Tokyo, 1996.
21. Tonelli, A. E. Polymers from the Inside Out; John Wiley & Sons, Inc.: New York, 2001
22. Brant, D. A.; Tonelli, A. E.; Flory, P. J. Macromolecules 1969, 2, 228-235
23. Meaurio, E.; Zuza, E.; Lopez-Rodriguez, N.; Sarasua, J. R. J. Phys. Chem. B 2006, 110, 5790-5800
24. Carbone, P.; Ragazzi, M.; Tritto, I.; Boggioni, L.; Ferro, D. R. Macromolecules 2003, 36, 891-899
25. Boggioni, L.; Bertini, F.; Zannoni, G.; Tritto, I.; Carbone, P.; Ragazzi, M.; Ferro, D. R. Macromolecules 2003, 36, 882-890
26. Wu, W.; Li, W.; Wang, L.; Zhang, P.; Zhang, J. THEOCHEM 2007, 816, 13-19
27. Kang, Y. K.; Byun, B. J. J. Phys. Chem. B 2008, 112, 9126-9134
28. Inai, Y.; Ogawa, H. Kobunshi Ronbunshu 2010, 67, 214-223
29. McAliley, J. H.; O'Brien, C. P.; Bruce, D. A. J. Phys. Chem. A 2008, 112, 7244-7249
30. Schafer, A.; Horn, H.; Ahlnichs, R. J. Chem. Phys. 1992, 97, 2571-2577
31. Schafer, A.; Huber, C.; Ahlnichs, R. J. Chem. Phys. 1994, 100, 5829-5835
32. Becke, A. D. J. Chem. Phys. 1993, 98, 5648-5652
33. London, F. J. Phys. Radium. 1937, 8, 397-409
34. McWeeny, R. Phys. Rev. 1962, 126, 1028-1034
35. Ditchfield, R. Mol. Phys. 1947, 27, 789-807
36. Wolinski, K.; Hilton, J. F.; Pulay, P. J. Am. Chem. Soc. 1990, 112, 8251-8260
37. Cheeseman, J. R.; Trucks, G. W.; Keith, T. A.; Frisch, M. J. J. Chem. Phys. 1996, 104, 5497-5509