Crystal Structure of Poly(octamethylene terephthalate) Determined by X-Ray Fiber Diffraction and Molecular Modeling
- Authors
- Jeong, Young Gyu; Lee, Sang Cheol; Shin, Kyusoon
- Issue Date
- 1-Feb-2009
- Publisher
- JOHN WILEY & SONS INC
- Keywords
- crystal structures; molecular modeling; polyesters; structure-property relations; thermal properties; WAXS; X-ray
- Citation
- JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS, v.47, no.3, pp 276 - 283
- Pages
- 8
- Journal Title
- JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS
- Volume
- 47
- Number
- 3
- Start Page
- 276
- End Page
- 283
- URI
- https://scholarworks.bwise.kr/kumoh/handle/2020.sw.kumoh/26671
- DOI
- 10.1002/polb.21638
- ISSN
- 0887-6266
1099-0488
- Abstract
- Poly(octamethylene terephthalate) (POT), a semicrystalline aromatic polyester, is synthesized by melt-condensation reaction, and its thermal property and crystal structure are investigated by using differential scanning calorimetry, X-ray diffraction, and molecular modeling methods, respectively. It is revealed that the synthesized POT sample has comparably low melting temperature of 131 degrees C and forms one crystalline phase. Based on two-dimensional X-ray fiber diagram and molecular modeling analyses, the crystal structure of POT is identified to be triclinic with dimensions of a = 4.560 angstrom, b = 5.597 angstrom, c = 18.703 angstrom, alpha = 104.87 degrees, beta = 119.45 degrees, and gamma = 100.32 degrees, in which one chemical repeating unit of POT with all-trans conformation of octamethylene group is packed according to the space group of P (1) over bar. (C) 2008 Wiley Periodicals, Inc. J Polym Sci Part B: Polym. Phys 47: 276-283, 2009
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