Home

Citation: Zhang Tian-Li, Xu Li-Jin, Yan Ji-Min, Kong Fan-Ao. A Quasiclassical Trajectory Study for Reaction of Chlorine with Propane[J]. Acta Physico-Chimica Sinica, ;1999, 15(11): 1045-1048. doi: 10.3866/PKU.WHXB19991117 shu

A Quasiclassical Trajectory Study for Reaction of Chlorine with Propane

1.
Institute of Chenistry,Chinese Academy of Sciences,Beijing 100080

Received Date: 31 December 1998
Available Online: 15 November 1999

The reaction of •Cl+CH(CH3)2•CH(CH3)2+HCl was studied by a 3 atom quasiclassical trajectory calculation. The results indicate that the angular distribution of HCl molecule does not show apparent anisotropy, and HCl is in the vibrationally ground state and the first excited state. The reaction trajectories show that a short lived collision complex is formed during the reaction process, so the angular distribution of product molecule does not show some intense scattering direction.
- Quasiclassical trajectory calculation,
- Propne,
- Collision complex
1. [1]
  Pei Li , Yuenan Zheng , Zhankai Liu , An-Hui Lu . Boron-Containing MFI Zeolite: Microstructure Control and Its Performance of Propane Oxidative Dehydrogenation. Acta Physico-Chimica Sinica, 2025, 41(4): 100034-0. doi: 10.3866/PKU.WHXB202406012
2. [2]
  Ruolin CHENG , Yue WANG , Xiyao NIU , Huagen LIANG , Ling LIU , Shijian LU . Efficient photothermal catalytic CO₂ cycloaddition over W₁₈O₄₉/rGO composites. Chinese Journal of Inorganic Chemistry, 2025, 41(7): 1276-1284. doi: 10.11862/CJIC.20240424
3. [3]
  Longfei MA , Fang SI , Congjie PAN , Xinhua WANG . Synthesis and crystal structure of extended tetrathiafulvalene derivatives and cupric bromide charge transfer complexes. Chinese Journal of Inorganic Chemistry, 2026, 42(6): 1229-1236. doi: 10.11862/CJIC.20250355
4. [4]
  Huafeng SHI . Construction of MnCoNi layered double hydroxide@Co-Ni-S amorphous hollow polyhedron composite with excellent electrocatalytic oxygen evolution performance. Chinese Journal of Inorganic Chemistry, 2025, 41(7): 1380-1386. doi: 10.11862/CJIC.20240378
5. [5]
  Tongqi Ye , Yanqing Wang , Qi Wang , Huaiping Cong , Xianghua Kong , Yuewen Ye . Reform of Classical Thermodynamics Curriculum from the Perspective of Computational Chemistry. University Chemistry, 2025, 40(7): 387-392. doi: 10.12461/PKU.DXHX202409128
6. [6]
  Xiaopei HE , Jing HAN , Zhong YU , Na YE , Yi WAN . Preparation and antimicrobial properties of polyvinyl alcohol composite film based on Ag(Ⅰ) complex. Chinese Journal of Inorganic Chemistry, 2026, 42(3): 531-542. doi: 10.11862/CJIC.20250271
7. [7]
  Cunling Ye , Xitong Zhao , Hongfang Wang , Zhike Wang . A Formula for the Calculation of Complex Concentrations Arising from Side Reactions and Its Applications. University Chemistry, 2024, 39(4): 382-386. doi: 10.3866/PKU.DXHX202310043
8. [8]
  Hong Wu , Yuxi Wang , Hongyan Feng , Xiaokui Wang , Bangkun Jin , Xuan Lei , Qianghua Wu , Hongchun Li . Application of Computational Chemistry in the Determination of Magnetic Susceptibility of Metal Complexes. University Chemistry, 2025, 40(3): 116-123. doi: 10.12461/PKU.DXHX202405141
9. [9]
  Chuanming GUO , Kaiyang ZHANG , Yun WU , Rui YAO , Qiang ZHAO , Jinping LI , Guang LIU . Performance of MnO₂-0.39IrO_x composite oxides for water oxidation reaction in acidic media. Chinese Journal of Inorganic Chemistry, 2024, 40(6): 1135-1142. doi: 10.11862/CJIC.20230459
10. [10]
  Ke Qiu , Fengmei Wang , Mochou Liao , Kerun Zhu , Jiawei Chen , Wei Zhang , Yongyao Xia , Xiaoli Dong , Fei Wang . A Fumed SiO₂-based Composite Hydrogel Polymer Electrolyte for Near-Neutral Zinc-Air Batteries. Acta Physico-Chimica Sinica, 2024, 40(3): 2304036-0. doi: 10.3866/PKU.WHXB202304036
11. [11]
  Ruoxi Sun , Yiqian Xu , Shaoru Rong , Chunmiao Han , Hui Xu . The Enchanting Collision of Light and Time Magic: Exploring the Footprints of Long Afterglow Lifetime. University Chemistry, 2024, 39(5): 90-97. doi: 10.3866/PKU.DXHX202310001
12. [12]
  Shengli Chen , Xinxin Zhao , Mingxue Xing , Xintai Li , Xiaojie Zhang , Xiuli Hu , Jimin Zhang . “一触即发”：聚羧酸减水剂和水泥的魔力碰撞. University Chemistry, 2025, 40(8): 315-322. doi: 10.12461/PKU.DXHX202410036
13. [13]
  Pingping Liu , Dandan Tang , Zhifeng Li , Xiaowen Han , Guoling Zhang , Pu Chen , Hai-Tao Feng . 古今“色”界碰撞——天然染料与合成染料的布艺实验. University Chemistry, 2026, 41(8): 250-259. doi: 10.12461/PKU.DXHX202507099
14. [14]
  Hongxiao Yang , Zhilian Liu , Weimin Zhang , Jitao Liu . Integratingscenario, knowledge, and problem lines in a problem-driven framework: teaching thermodynamics and kinetics in general chemistry. University Chemistry, 2026, 41(6): 100-107. doi: 10.12461/PKU.DXHX202511184
15. [15]
  Hongyu Cheng , Ruiyao Wang , Xingwen Sun . Mechanistic Study of the Classic Hofmann Elimination Reaction. University Chemistry, 2025, 40(12): 187-191. doi: 10.12461/PKU.DXHX202510104
16. [16]
  Yaping ZHANG , Tongchen WU , Yun ZHENG , Bizhou LIN . Z-scheme heterojunction β-Bi₂O₃ pillared CoAl layered double hydroxide nanohybrid: Fabrication and photocatalytic degradation property. Chinese Journal of Inorganic Chemistry, 2025, 41(3): 531-539. doi: 10.11862/CJIC.20240256
17. [17]
  Xinmeng Huang , Haoran Zhang , Mengxin Liu , Ying Miao , Zhenxi Yu , Qi Wu , Lei Pan . A densified conductive network of carbon nanotube-bridged vertical ZnO arrays for enhanced electromagnetic interference shielding, mechanical, and thermal properties of carbon fiber/polymer composites. Acta Physico-Chimica Sinica, 2026, 42(10): 100293-0. doi: 10.1016/j.actphy.2026.100293
18. [18]
  Hongbo Hou , Qian Yang , Yi Gao , Yang Ou , Zhuang Wang , Shun Yi , Jingfeng He , Li Ma , Fanbin Meng . Progress in supercritical CO₂ foamed polymer composites for electromagnetic protection: from rational structural design to absorption-dominated performance. Acta Physico-Chimica Sinica, 2026, 42(10): 100300-0. doi: 10.1016/j.actphy.2026.100300
19. [19]
  Qingying Gao , Tao Luo , Jianyuan Su , Chaofan Yu , Jiazhu Li , Bingfei Yan , Wenzuo Li , Zhen Zhang , Yi Liu . Refinement and Expansion of the Classic Cinnamic Acid Synthesis Experiment. University Chemistry, 2024, 39(5): 243-250. doi: 10.3866/PKU.DXHX202311074
20. [20]
  Qiang Wu , Wenhua Hou . Teaching Classical Contents Newly: Taking Temperature–Entropy Diagram as an Example. University Chemistry, 2025, 40(4): 399-407. doi: 10.12461/PKU.DXHX202407102

Get Citation

PDF

XML

Metrics

PDF Downloads(2262)
Abstract views(3511)
HTML views(59)

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142

Address：Zhongguancun North First Street 2,100190 Beijing, PR China Tel: +86-010-82449177-888

DownLoad: Full-Size Img PowerPoint

Return