Experimental and computational insights into energy contributions of intermolecular interactions

被引：0
|
作者：
Bhowal, Rohit [1 ]
Chopra, Deepak [2 ]
机构：
[1] Indian Inst Sci Educ & Res, Kolkata, India
[2] Indian Inst Sci Educ & Res, Bhopal, India
来源：
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES | 2017年 / 73卷
关键词：
Intermolecular Interactions; Flourine; Crystal Packing;
D O I：
10.1107/S2053273317086703
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
MS035.P01
引用
收藏
页码：C904 / C904
页数：1
相关论文
共 50 条
  • [1] Experimental and computational investigation of intermolecular interactions in cyclopentanone with methanol mixture
    Zhang, Yu-Feng
    Huang, Rong-Yi
    Wang, Jun-Wei
    Geng, Tong-Mou
    Zhao, Shun-Ping
    Wu, Gen-Hua
    Chemical Physics Letters, 2014, 612 : 223 - 228
  • [2] Experimental and computational investigation of intermolecular interactions in cyclopentanone with methanol mixture
    Zhang, Yu-Feng
    Huang, Rong-Yi
    Wang, Jun-Wei
    Geng, Tong-Mou
    Zhao, Shun-Ping
    Wu, Gen-Hua
    CHEMICAL PHYSICS LETTERS, 2014, 612 : 223 - 228
  • [3] Microwave spectroscopic and computational analyses of the phenylacetylene⋯methanol complex: insights into intermolecular interactions
    Gupta, Surabhi
    Cummings, Charlotte N.
    Walker, Nicholas R.
    Arunan, Elangannan
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2024, 26 (29) : 19795 - 19811
  • [4] Intermolecular interactions between σ- and π-holes of bromopentafluorobenzene and pyridine: computational and experimental investigations
    Yang, Fang-Ling
    Yang, Xing
    Wu, Rui-Zhi
    Yan, Chao-Xian
    Yang, Fan
    Ye, Weichun
    Zhang, Liang-Wei
    Zhou, Pan-Pan
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 20 (16) : 11386 - 11395
  • [5] Quantitative insights into energy contributions of intermolecular interactions in fluorine and trifluoromethyl substituted isomeric N-phenylacetamides and N-methylbenzamides
    Panini, Piyush
    Chopra, Deepak
    CRYSTENGCOMM, 2013, 15 (18) : 3711 - 3733
  • [6] Insights into Intermolecular Interactions of Spironolactone Solvates
    Jia, Lihong
    Zhang, Shihao
    Yang, Wenchao
    Bao, Ying
    Hou, Baohong
    Zhou, Ling
    Yin, Qiuxiang
    CRYSTAL GROWTH & DESIGN, 2021, 21 (07) : 3677 - 3688
  • [7] On the theoretical rationalization of intermolecular interactions: insights from DFT energy partitioning schemes
    Alipour, Mojtaba
    Taravat, Faezeh
    THEORETICAL CHEMISTRY ACCOUNTS, 2018, 137 (11)
  • [8] Insights into the Nature of Intermolecular Interactions in Low-Energy Conformers of Perindopril Erbumine
    Czernek, Jiri
    MCBC'09: PROCEEDINGS OF THE 10TH WSEAS INTERNATIONAL CONFERENCE ON MATHEMATICS AND COMPUTERS IN BIOLOGY AND CHEMISTRY, 2009, : 190 - +
  • [9] On the theoretical rationalization of intermolecular interactions: insights from DFT energy partitioning schemes
    Mojtaba Alipour
    Faezeh Taravat
    Theoretical Chemistry Accounts, 2018, 137
  • [10] Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides
    Panini, Piyush
    Chopra, Deepak
    NEW JOURNAL OF CHEMISTRY, 2015, 39 (11) : 8720 - 8738
12345