Crystal structure of 2-(4,6-dimethyl-12,13-dihydro-6H-6,12-methanobenzo [7,8][1,5]oxazocino[3,4-g]quinolin-2-yl)phenol and its recognition of Sn4+

被引：0
|
作者：
Zhou, Ying [1 ]
Ye, Xin-ru [1 ]
Tan, Xin-xin [1 ]
Huang, Wan-ting [1 ]
Zhang, De-Hua [1 ]
机构：
[1] Hubei Normal Univ, Hubei Key Lab Pollutant Anal & Reuse Technol, Coll Chem & Chem Engn, Huangshi 435002, Hubei, Peoples R China
来源：
JOURNAL OF MOLECULAR STRUCTURE | 2025年 / 1328卷
关键词：
Quinoline; Hirshfeld surface; Sn4+;
D O I：
10.1016/j.molstruc.2025.141362
中图分类号：
O64 [物理化学（理论化学）、化学物理学];
学科分类号：
070304 ; 081704 ;
摘要：
This paper synthesized a quinoline derivative chemical sensor consisting of three components of amine-aldehyde- acetone, which was used to detect Sn4+ in acetonitrile. The detection limit for Sn4+ was 3.26 x 10-6 M The crystal structure was determined by single crystal X-ray diffraction. The title compound is L-shaped, with phenol and quinoline rings in the same plane. CrystalExplorer 17.5 was used to calculate Hirschfeld surfaces and twodimensional fingerprints. Using Multiwfn combined with VMD, RDG color filled surfaces are plotted and the weak intermolecular interactions are discussed. The results of theoretical calculation agree well with those of crystallographic analysis.
引用
收藏
页数：8
相关论文
共 50 条
  • [1] Crystal structure of 2-(5-phenyl-1-(quinolin-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)phenol, C24H19N3O
    Zeng, Dai
    Tan, Kai
    Fang, Ziyan
    Xing, Aiping
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 2023, 238 (06): : 1153 - 1155
  • [2] Hydrogen-bonded chains in isostructural 5-methyl-2-(4-methylphenyl)-7,8-dihydro-6H-cyclopenta[g]pyrazolo[1,5-a]pyrimidine, 2-(4-chlorophenyl)-5-methyl-7,8-dihydro-6H-cyclopenta[g]pyrazolo[1,5-a]pyrimidine and 2-(4-bromophenyl)-5-methyl-7,8-dihydro-6H-cyclopenta[g]pyrazolo[1,5-a]pyrimidine, and sheets of π-stacked hydrogen-bonded chains in 2-(4-methoxyphenyl)-5-methyl-7,8-dihydro-6H-cyclopenta[g]pyrazolo [1,5-a]pyrimidine
    Portilla, J
    Quiroga, J
    Cobo, J
    Low, JN
    Glidewell, C
    ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY, 2005, 61 : O452 - O456
  • [3] 2-{1-[2,8-Bis(trifluoromethyl)quinolin-4-yl]-3,5,6,7,8,8a-hexahydro-1H-1,3-oxazolo[3,4-a]pyridin-3-yl}phenol
    Goncalves, Raoni S. B.
    Kaiser, Carlos R.
    de Souza, Marcus V. N.
    Wardell, James L.
    Wardell, Solange M. S. V.
    Tiekink, Edward R. T.
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2011, 67 : O1656 - U422
  • [4] Crystal structure of 4-(4-methoxyphenyl)-7,7-dimethyl-2-methylamino-3-nitro7,8-dihydro-4H-chromen-5(6H)-one
    Inglebert, S. Antony
    Kamalraja, Jayabal
    Sethusankar, K.
    Perumal, Paramasivam T.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2014, 70 : O901 - +
  • [5] Synthesis and crystal structure of 3-N-acetyl-5-(pyridin-3-yl)-2-(quinolin-2-yl)-1,3,4-oxadiazoline, C18H14N4O2
    Yu, Xiang
    Peng, Lu
    Wang, Xin
    Chen, Ya-Fang
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 2020, 235 (05): : 1067 - 1068
  • [6] Crystal structure of 1-[5-(3,4-difluorophenyl)-2-methylthiophen-3-yl]-2-(2-cyano-1,5-dimethyl-1H-pyrrol-4-yl)-3,3,4,4,5,5-hexafluoro-cyclopent-1-ene, C23H14F8N2S
    Cui, Shiqiang
    Li, Hui
    Fan, Congbin
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 2013, 228 (02): : 290 - 292
  • [7] Crystal structure of 4-(2-(benzo[b]thiophen-2-yl)-3,3,4,4,5,5-hexafluorocyclopent-1-en-1-yl)-1,5-dimethyl-1H-pyrrole-2-carbonitrile, C20H12F6N2S
    Li, Ying
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 2020, 235 (06): : 1457 - 1459
  • [8] CRYSTAL-STRUCTURE OF[1,2,5]THIADIAZOLO[3,4-G]BENZOFURAZAN 1-OXIDE, C6H2N4O2S
    CALLERI, M
    BONACCORTI, L
    VITERBO, D
    ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1977, 33 (DEC): : 3685 - 3688
  • [9] Crystal structure of 3-(4-bromophenyl)-4,6-dimethyl-1-pyrid-3-yl-methylaminoimidazo-[1,5-b]pyridazine, (C6H4Br)(C6H7N2)C6HN3(CH3)2
    Peters, K
    Peters, EM
    Irrgang, T
    Hetzheim, A
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 1999, 214 (03): : 343 - 344
  • [10] 6,8-Di-tert-butyl-3-(2,4-dimethyl-quinolin-7-yl)-3,4-dihydro-2H-benzo[e][1,3]oxazine: Synthesis, Crystal Structure and Luminescent Properties
    苏清
    赵天琦
    张杰
    李佩
    赵晴
    叶玲
    Chinese Journal of Structural Chemistry, 2014, (02) : 237 - 243
12345