Computational study of physicochemical, optical, and thermodynamic properties of 2,2-dimethylchromene derivatives

被引：0
|
作者：
J. R. Eone
Y. Tadjouteu Assatse
R. A. Yossa Kamsi
M. T. Ottou Abe
J. M. B. Ndjaka
机构：
[1] University of Yaoundé I,Faculty of Science, Department of Physics
来源：
Journal of Molecular Modeling | 2023年 / 29卷
关键词：
Chromene derivatives; Local and global reactivity; Lipophilicity; Hyperpolarizability; Molecular flexibility;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
相关论文
共 50 条
  • [31] Physicochemical Properties and Thermodynamic Parameters of Methyl-Substituted Naphthalene Derivatives
    Ozerenko, A. A.
    Gyul'maliev, A. M.
    Gagarin, S. G.
    COKE AND CHEMISTRY, 2007, 50 (10) : 304 - 309
  • [32] A computational study of the nonlinear optical properties of carbazole derivatives: theory refines experiment
    Alejandro J. Garza
    Osman Ibrahim Osman
    Nuha Ahmed Wazzan
    Sher Bahadar Khan
    Abdullah Mohamed Asiri
    Gustavo E. Scuseria
    Theoretical Chemistry Accounts, 2014, 133
  • [33] Computational study of novel pentacene derivatives: Prediction of structural, electronic, and optical properties
    Petralia, Salvatore
    Forte, Giuseppe
    JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2023, 36 (02)
  • [34] Computational studies on electronic and optical properties of dopamine derivatives structure: A DFT study
    Jabbar, Mohammed L.
    JOURNAL OF THE MECHANICAL BEHAVIOR OF MATERIALS, 2021, 30 (01) : 279 - 284
  • [35] A computational study of the nonlinear optical properties of carbazole derivatives: theory refines experiment
    Garza, Alejandro J.
    Osman, Osman Ibrahim
    Wazzan, Nuha Ahmed
    Khan, Sher Bahadar
    Asiri, Abdullah Mohamed
    Scuseria, Gustavo E.
    THEORETICAL CHEMISTRY ACCOUNTS, 2014, 133 (04) : 1 - 8
  • [36] THERMODYNAMIC PROPERTIES OF LIQUID 2,2-DIFLUOROETHANOL
    MALHOTRA, R
    WOOLF, LA
    INTERNATIONAL JOURNAL OF THERMOPHYSICS, 1995, 16 (04) : 901 - 908
  • [37] Thermodynamic properties of quinoxaline-1,4-dioxide derivatives:: A combined experimental and computational study
    da Silva, MDMCR
    Gomes, JRB
    Gonçalves, JM
    Sousa, EA
    Pandey, S
    Acree, WE
    JOURNAL OF ORGANIC CHEMISTRY, 2004, 69 (08): : 2785 - 2792
  • [38] Thermodynamic properties of fluoranthene: An experimental and computational study
    Monte, Manuel J. S.
    Notario, R.
    Pinto, Sonia P.
    Lobo Ferreira, Ana I. M. C.
    Ribeiro da Silva, Maria D. M. C.
    JOURNAL OF CHEMICAL THERMODYNAMICS, 2012, 49 : 159 - 164
  • [39] Synthesis, physicochemical properties and computational study of donor-acceptor polymer for optical limiting application
    Vishnumurthy, K. A.
    Girish, K. H.
    Adhikari, A. V.
    SN APPLIED SCIENCES, 2020, 2 (10):
  • [40] STUDY OF THE OPTICAL PROPERTIES OF 2-THIOHYDANTOIN DERIVATIVES
    Smarandache, Adriana
    Pascu, A.
    Andrei, I. R.
    Handzlik, Jadwiga
    Kiec-Kononowicz, Katarzyna
    Staicu, Angela
    Pascu, M. L.
    ROMANIAN REPORTS IN PHYSICS, 2016, 68 (02) : 673 - 683
12345