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  • By means of quantum chemical DFT calculations, the complex structure of a hexaarylbenzene-based receptor with Na+ was derived. In the resulting complex having C3 symmetry, the sodium cation synergistically interacts with the hydrophilic polar ethereal oxygen fence and with the central hydrophobic benzene bottom of the parent receptor via cation–.pi. interaction.
  • By means of quantum chemical DFT calculations, the complex structure of a hexaarylbenzene-based receptor with Na+ was derived. In the resulting complex having C3 symmetry, the sodium cation synergistically interacts with the hydrophilic polar ethereal oxygen fence and with the central hydrophobic benzene bottom of the parent receptor via cation–.pi. interaction. (en)
Title
  • Theoretical study on the complexation of the sodium cation with a hexaarylbenzene-based receptor
  • Theoretical study on the complexation of the sodium cation with a hexaarylbenzene-based receptor (en)
skos:prefLabel
  • Theoretical study on the complexation of the sodium cation with a hexaarylbenzene-based receptor
  • Theoretical study on the complexation of the sodium cation with a hexaarylbenzene-based receptor (en)
skos:notation
  • RIV/61389013:_____/10:00350519!RIV11-GA0-61389013
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GAP205/10/2280), S, Z(AV0Z40500505), Z(AV0Z40550506), Z(MSM4977751303)
http://linked.open...iv/cisloPeriodika
  • 12
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
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http://linked.open...dnocenehoVysledku
  • 292664
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  • RIV/61389013:_____/10:00350519
http://linked.open...riv/jazykVysledku
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  • receptors; macrocycles; compexation (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...odStatuVydavatele
  • AT - Rakouská republika
http://linked.open...ontrolniKodProRIV
  • [9DBEBEFF1447]
http://linked.open...i/riv/nazevZdroje
  • Monatshefte fur Chemie
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http://linked.open...ichTvurcuVysledku
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...v/svazekPeriodika
  • 141
http://linked.open...iv/tvurceVysledku
  • Kašička, Václav
  • Makrlík, E.
  • Rathore, R.
  • Toman, Petr
  • Vaňura, P.
http://linked.open...ain/vavai/riv/wos
  • 000284160900006
http://linked.open...n/vavai/riv/zamer
issn
  • 0026-9247
number of pages
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