Korean Journal of Crystallography (한국결정학회지)
- Volume 8 Issue 1
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- Pages.59-63
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- 1997
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- 1229-8700(pISSN)
Calculation of the Ideal Positions of Hydrogen Atoms in Compounds
화합물내에서의 수소원자의 이상적 위치계산
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Suh Il-Bwan
(Department of Physics, Chungnam National University) ;
- Kim Kyung-Han (Department of Physics, Chungnam National University) ;
- Oh Mi-Ran (Department of Physics, Chungnam National University) ;
- Park Koon Ha (Department of Chemistry, Chungnam National University) ;
- Kim Moon-Jib (Department of Physics, Soon Chun Hyang University)
- Published : 1997.06.01
Abstract
A method for the calculation of the idealized hydrogen positions in the following seven different kinds of compounds has been shown: (1) tertiary C-H, (2) secondary C-H, (3)
화합물내에 존재하는 다음 7가지 수소원자의 이상적인 위치들의 한가지 계산법을 보였다. (1) 3급 C-H, (2) 2급 C-H, (3) 1급 C-H, (4) 방향환 C-H와 N-H, (5) 수산기 O-H, (6) 말단평면내의 2개의 수소 (7) 선형인 X-C-H를 갖는 아세틸렌 C-H.
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