APPROACH TO THE CONFORMATIONAL BEHAVIOR OF TETRAAZAMACROCYCLES IN THE SOLUTION-STATE - NMR AND MOLECULAR MODELING STUDIES

被引：2
|
作者：
BOETZEL, R
FAILLA, S
FINOCCHIARO, P
HAGELE, G
机构：
[1] UNIV DUSSELDORF,INST ANORGAN CHEM & STRUKTURCHEM 1,D-40225 DUSSELDORF,GERMANY
[2] UNIV CATANIA,FAC INGN,IST CHIM,I-95125 CATANIA,ITALY
来源：
MAGNETIC RESONANCE IN CHEMISTRY | 1995年 / 33卷 / 02期
关键词：
MACROCYCLES NMR; H-1; NMR; C-13; MOLECULAR MODELING; CONFORMATION;
D O I：
10.1002/mrc.1260330208
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
The differences in complexation behaviour of two diastereomeric tetraazamacrocycles, meso (1) and racemic (2) 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane, are explained by different conformations in solution, 1 being one stable conformer of almost rigid structure while 2 shows higher conformational flexibility to avoid steric strain, The methods used were H-1 and C-13 NMR and molecular modelling.
引用
收藏
页码：128 / 133
页数：6
相关论文
共 50 条
  • [1] Conformational characterization of duplex DNA with solution-state NMR spectroscopy
    Sathyamoorthy, Bharathwaj
    Sannapureddi, Rajesh Kumar Reddy
    Negi, Deepraj
    Singh, Pooja
    JOURNAL OF MAGNETIC RESONANCE OPEN, 2022, 10-11
  • [2] Solution-state conformational study of the hevamine inhibitor allosamidin and six potential inhibitor analogues by NMR spectroscopy and molecular modeling
    Germer, A
    Peter, MG
    Kleinpeter, E
    JOURNAL OF ORGANIC CHEMISTRY, 2002, 67 (18): : 6328 - 6338
  • [3] NMR AND MOLECULAR MECHANICS STUDIES ON THE SOLUTION-STATE CONFORMATION OF (-)-SCOPOLAMINE FREE BASE
    GLASER, R
    MAGNETIC RESONANCE IN CHEMISTRY, 1993, 31 (04) : 335 - 339
  • [4] SOLUTION-STATE NMR-STUDIES OF POLYANILINE STRUCTURE
    KENWRIGHT, AM
    FEAST, WJ
    ADAMS, P
    MILTON, AJ
    MONKMAN, AP
    SAY, BJ
    SYNTHETIC METALS, 1993, 55 (01) : 666 - 671
  • [5] Solution-state NMR studies on human prion protein mutants
    Giachin, Gabriele
    Ilc, Gregor
    Biljan, Ivana
    Plavec, Janez
    Legname, Giuseppe
    PRION, 2014, 8 : 41 - 41
  • [6] Assigning methyl resonances for protein solution-state NMR studies
    Gorman, Scott D.
    Sahu, Debashish
    O'Rourke, Kathleen F.
    Boehr, David D.
    METHODS, 2018, 148 : 88 - 99
  • [7] Environmental NMR: Solution-State Methods
    Hertkorn, Norbert
    EMAGRES, 2014, 3 (01): : 55 - 74
  • [8] Solution-State NMR of Lignocellulosic Biomass
    Lu, Fachuang
    Ralph, John
    JOURNAL OF BIOBASED MATERIALS AND BIOENERGY, 2011, 5 (02) : 169 - 180
  • [9] Solution-state NMR studies of the surface structure and dynamics of semiconductor nanocrystals
    Sachleben, JR
    Colvin, V
    Emsley, L
    Wooten, EW
    Alivisatos, AP
    JOURNAL OF PHYSICAL CHEMISTRY B, 1998, 102 (50): : 10117 - 10128
  • [10] CONFORMATIONAL STUDIES OF NEUROACTIVE LIGANDS .2. SOLUTION-STATE CONFORMATIONS OF ACETYLCHOLINE
    WILSON, KJ
    DERREUMAUX, P
    VERGOTEN, G
    PETICOLAS, WL
    JOURNAL OF PHYSICAL CHEMISTRY, 1989, 93 (04): : 1351 - 1357
12345