Chemical shift assignment of mono- and di-bromo triimidazo[1,2-a:1',2'-c:1″,2″-e][1,3,5]triazine derivatives by DFT/NMR integrated approach

Chemical shift assignment of mono- and di-bromo triimidazo[1,2-a:1',2'-c:1″,2″-e][1,3,5]triazine derivatives by DFT/NMR integrated approach

© 2018 John Wiley & Sons, Ltd.

Bibliographische Detailangaben
Veröffentlicht in:Magnetic resonance in chemistry : MRC. - 1985. - (2018) vom: 13. Nov.
1. Verfasser: Di Micco, Simone (VerfasserIn)
Weitere Verfasser: Giannini, Clelia, Previtali, Andrea, Lucenti, Elena, Bifulco, Giuseppe
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2018
Zugriff auf das übergeordnete Werk:Magnetic resonance in chemistry : MRC
Schlagworte:Journal Article 13C 15N 1H DFT NMR aggregation-induced emitters chemical shift cyclic triimidazole spin-spin coupling constants
LEADER 01000caa a22002652 4500
001 NLM290543754
003 DE-627
005 20240229162029.0
007 cr uuu---uuuuu
008 231225s2018 xx |||||o 00| ||eng c
024 7 |a 10.1002/mrc.4804  |2 doi 
028 5 2 |a pubmed24n1308.xml 
035 |a (DE-627)NLM290543754 
035 |a (NLM)30421826 
040 |a DE-627  |b ger  |c DE-627  |e rakwb 
041 |a eng 
100 1 |a Di Micco, Simone  |e verfasserin  |4 aut 
245 1 0 |a Chemical shift assignment of mono- and di-bromo triimidazo[1,2-a:1',2'-c:1″,2″-e][1,3,5]triazine derivatives by DFT/NMR integrated approach 
264 1 |c 2018 
336 |a Text  |b txt  |2 rdacontent 
337 |a ƒaComputermedien  |b c  |2 rdamedia 
338 |a ƒa Online-Ressource  |b cr  |2 rdacarrier 
500 |a Date Revised 27.02.2024 
500 |a published: Print-Electronic 
500 |a Citation Status Publisher 
520 |a © 2018 John Wiley & Sons, Ltd. 
520 |a Mono- and di-bromo derivatives of triimidazo[1,2-a:1',2'-c:1″,2″-e][1,3,5]triazine have been proposed as new organic molecules presenting a very rich and complex photophysical behavior. Thus, we afforded the correct chemical shift assignment by integrating the experimental data with DFT calculation of NMR parameters. Our findings lay foundation for a structural reference in the organic synthesis and characterization of new congeners of this intriguing class of molecules 
650 4 |a Journal Article 
650 4 |a 13C 
650 4 |a 15N 
650 4 |a 1H 
650 4 |a DFT 
650 4 |a NMR 
650 4 |a aggregation-induced emitters 
650 4 |a chemical shift 
650 4 |a cyclic triimidazole 
650 4 |a spin-spin coupling constants 
700 1 |a Giannini, Clelia  |e verfasserin  |4 aut 
700 1 |a Previtali, Andrea  |e verfasserin  |4 aut 
700 1 |a Lucenti, Elena  |e verfasserin  |4 aut 
700 1 |a Bifulco, Giuseppe  |e verfasserin  |4 aut 
773 0 8 |i Enthalten in  |t Magnetic resonance in chemistry : MRC  |d 1985  |g (2018) vom: 13. Nov.  |w (DE-627)NLM098179667  |x 1097-458X  |7 nnns 
773 1 8 |g year:2018  |g day:13  |g month:11 
856 4 0 |u http://dx.doi.org/10.1002/mrc.4804  |3 Volltext 
912 |a GBV_USEFLAG_A 
912 |a SYSFLAG_A 
912 |a GBV_NLM 
912 |a GBV_ILN_350 
951 |a AR 
952 |j 2018  |b 13  |c 11