The Crystal and Molecular Structure of N1-Cyclohexyl-N2-(o-Chlorobenzal) Imino Thiourea

• 발행기관: 대한약학회
• 저자명: Chung Hoe Koo Hojing Kim Hoon Sup Kim Chong Whan Chang
• 간행물 정보: 『약학회지』제21권 제3호 (1977년), 146~158쪽, 전체 13쪽
• 주제분류: 의약학 > 기타의약학
• 파일형태: PDF
• 발행일자: 1977.09.30

영문 초록

N1-Cyclohexyl-N2-(o-chlorobenzal) imino thiourea, C14H18 N3SCl, crystallizes in C2/c, with a=19.68, b=7.74, c=20.42angstrom, beta=92.8o and eight formula units in the unit cell. The structure was solved by the study of Patterson sections, calculated from three-dimensional film data, and was refined by block-diagonal least-squares methods to R=0.16 based on 1288 independent intensity data. The rest atoms of N1-Cyclohexyl-N2-(o-chlorobenzal) imino thiourea molecule excluding cyclohexan ring and chlorine atoms approximately lie on a plane. A pair of molecules related by the symmetry centers are connected directly with the N-H...... S hydrogen bonds. Apart from the hydrogen bonding system the structure is held together by the van der Waals forces.