[99Tcm(NO)Cl(PL)2]＋类配合物的定量构效关系

doi:10.3866/PKU.WHXB20030517

Acta Phys. -Chim. Sin. ›› 2003, Vol. 19 ›› Issue (05): 460-463.doi: 10.3866/PKU.WHXB20030517

• Note • Previous Articles Next Articles

QSAR of [⁹⁹Tc^m(NO)Cl(PL)₂]^＋ Complexes

Zhang Hua-Bei;Li Bo;Dai Mei

Department of Chemistry, Beijing Normal University, Beijing　100875

Received:2002-09-02 Revised:2002-11-05 Published:2003-05-15

Abstract

Abstract: The geometries of fifteen [99Tcm(NO)Cl(PL)2]＋ complexes were optimized by semi-empirical quantum mechanics method——ZINDO/1 and many physical and chemical descriptors were obtained. Four equations were obtained by the multiple regressions between these drescriptors and heart intial uptake. New uptake mechanism of redox mechanism was revealed when analyzing these equations.

Key words: ZINDO/1, Heart uptake, Uptake mechanism, Redox, QSAR(quantitive structure-activity relationship)

Zhang Hua-Bei;Li Bo;Dai Mei. QSAR of [⁹⁹Tc^m(NO)Cl(PL)₂]^＋ Complexes[J].Acta Phys. -Chim. Sin., 2003, 19(05): 460-463.

[1]	Guangtao Cong, Yi-Chun Lu. Strategies to Improve the Energy Density of Non-Aqueous Organic Redox Flow Batteries [J]. Acta Phys. -Chim. Sin., 2022, 38(6): 2106008-.
[2]	Bingyan Xu, Ying Zhang, Yecan Pi, Qi Shao, Xiaoqing Huang. Research Progress of Nickel-Based Metal-Organic Frameworks and Their Derivatives for Oxygen Evolution Catalysis [J]. Acta Phys. -Chim. Sin., 2021, 37(7): 2009074-.
[3]	Jing Zhang, Lina Wang, Xiaofei Chen, Yufeng Wang, Chengyan Niu, Lixin Wu, Zhiyong Tang. Redox-Regulated Dynamic Self-Assembly of a Lindqvist-Type Polyoxometalate Complex [J]. Acta Physico-Chimica Sinica, 2020, 36(9): 1912002-.
[4]	Jingxuan Ge, Jun Hu, Yingting Zhu, Zonish Zeb, Dejin Zang, Zhaoxian Qin, Yichao Huang, Jiangwei Zhang, Yongge Wei. Recent Advances in Polyoxometalates for Applications in Electrocatalytic Hydrogen Evolution Reaction [J]. Acta Physico-Chimica Sinica, 2020, 36(1): 1906063-.
[5]	Xiaobing YANG,Lei ZHAO,Xulei SUI,Linghui MENG,Zhenbo WANG. Ultra-High Proton/Vanadium Selectivity of Polybenzimidazole Membrane by Incorporating Phosphotungstic Acid Functionalized Nanofibers for Vanadium Redox Flow Battery [J]. Acta Physico-Chimica Sinica, 2019, 35(12): 1372-1381.
[6]	Chunhe YANG,Aiwei TANG,Feng TENG,Kejian JIANG. Electrochemistry of Perovskite CH₃NH₃PbI₃ Crystals [J]. Acta Phys. -Chim. Sin., 2018, 34(11): 1197-1201.
[7]	Hui-Jun YAN,Biao LI,Ning JIANG,Ding-Guo XIA. First-Principles Study:the Structural Stability and Sulfur Anion Redox of Li_1-xNiO_2-yS_y [J]. Acta Phys. -Chim. Sin., 2017, 33(9): 1781-1788.
[8]	Wei-Wei KONG,Shuang GUO,Yong-Min ZHANG,Xue-Feng LIU. Redox-Responsive Interfacial Properties of Se-Containing Sulfobetaine Surfactant [J]. Acta Phys. -Chim. Sin., 2017, 33(6): 1205-1213.
[9]	WANG Yu-Qiao, WANG Pan-Pan, LU Jing, BAI Yi-Chao, GU Yun-Liang, SUN Yue-Ming. Dye-Sensitized Solar Cells Based on MWCNT/TiO₂ Counter Electrode and Thiolate/Disulfide Non-Iodine Redox Couple [J]. Acta Phys. -Chim. Sin., 2015, 31(3): 448-456.
[10]	ZHU Chang-Li, WANG Wen-Yong, TIAN Dong-Mei, WANG Jiao, QIU Yong-Qing. Second-Order Nonlinear Optical Properties of Bis-Cyclometalated Iridium(Ⅲ) Isocyanide Complexes [J]. Acta Phys. -Chim. Sin., 2015, 31(2): 245-252.
[11]	GUO Li-Mei, KUANG Yuan-Jiang, YANG Xiao-Dan, YU Yan-Long, YAO Jiang-Hong, CAO Ya-An. Photocatalytic Reduction of CO₂ into CH₄ Using SrB₂O₄ Catalyst [J]. Acta Phys. -Chim. Sin., 2013, 29(02): 397-402.
[12]	CHEN Wen-Long, LIU Hai-Chao. Relationship between the Structures of Metal Oxide Catalysts and Their Properties in Selective Oxidation of Methanol [J]. Acta Phys. -Chim. Sin., 2012, 28(10): 2315-2326.
[13]	REN Chun-Yan, LU Hai, JIA Ming, ZHANG Zhi-An, LAI Yan-Qing, LI Jie. Application of 1,2-Dimethoxy-4-nitro-benzene and 1,4-Dimethoxy- 2-nitro-benzene as Overcharge Protection Additives in Lithium-Ion Batteries [J]. Acta Phys. -Chim. Sin., 2012, 28(09): 2091-2096.
[14]	SU An-Qun, WANG Nan-Fang, LIU Su-Qin, WU Tao, PENG Sui. Modification of Carbon Paper Electrode via Hydrothermal Oxidation Applied in the Vanadium Redox Battery [J]. Acta Phys. -Chim. Sin., 2012, 28(06): 1387-1392.
[15]	HOU Ruo-Bing, SUN Yan-Li, WANG Bei-Bei. One-Electron Redox Characteristics of One-Hydroxyl Radical Adducts of A-T Base Pairs [J]. Acta Phys. -Chim. Sin., 2012, 28(01): 73-77.

QSAR of [⁹⁹Tc^m(NO)Cl(PL)₂]^＋ Complexes

PDF

Like

Knowledge

Abstract

Cite this article

share this article

References

Related Articles 15

Metrics

Recommended 0

QSAR of [99Tcm(NO)Cl(PL)2]＋ Complexes

PDF

Like

Knowledge

Abstract

Cite this article

share this article

References

Related Articles 15

Metrics

Recommended 0

QSAR of [⁹⁹Tc^m(NO)Cl(PL)₂]^＋ Complexes