ANALYSIS OF CRYSTAL PACKING FOR TCNQ COMPLEXES
文献类型:期刊论文
作者 | Jian Minxie1; Fu Heng1; Tang Youqi1; Xu Xiaojie2 |
刊名 | ACTA PHYSICO-CHIMICA SINICA
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出版日期 | 1988 |
卷号 | 4期号:2页码:117-122 |
ISSN号 | 1000-6818 |
DOI | 10.3866/PKU.WHXB19880202 |
英文摘要 | This paper deals with 1-N-methyl-cinnoline TCNQ complex(1-N-M-cl TCNQ(2)) and 2-N-methyl-cinnoline TCNQ complex (2-N-M TCNQ(2)), The molecular packing analyses of both complex crystals were performanced by using. OPEC program, The potential energies of 1-N-M TCNQ(2) and 2-N-M TCNQ(2) are -70,194 kcal mol(-1) and -66,945 kcal mol(-1), respectively. The result shows that the less anisotropy in dimensions of planar dondor molecules is, the less effect on the arrangement of TCNQ and the more favourable for TCNQ molecules to arrange in one-dimensional column there is. |
语种 | 英语 |
WOS记录号 | WOS:000207571300001 |
出版者 | PEKING UNIV PRESS |
源URL | [http://ir.iccas.ac.cn/handle/121111/74013] ![]() |
专题 | 中国科学院化学研究所 |
通讯作者 | Jian Minxie |
作者单位 | 1.Acad Sinica, Inst Chem, Beijing 100080, Peoples R China 2.Peking Univ, Inst Phys Chem, Beijing, Peoples R China |
推荐引用方式 GB/T 7714 | Jian Minxie,Fu Heng,Tang Youqi,et al. ANALYSIS OF CRYSTAL PACKING FOR TCNQ COMPLEXES[J]. ACTA PHYSICO-CHIMICA SINICA,1988,4(2):117-122. |
APA | Jian Minxie,Fu Heng,Tang Youqi,&Xu Xiaojie.(1988).ANALYSIS OF CRYSTAL PACKING FOR TCNQ COMPLEXES.ACTA PHYSICO-CHIMICA SINICA,4(2),117-122. |
MLA | Jian Minxie,et al."ANALYSIS OF CRYSTAL PACKING FOR TCNQ COMPLEXES".ACTA PHYSICO-CHIMICA SINICA 4.2(1988):117-122. |
入库方式: OAI收割
来源:化学研究所
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