2-Methylresorcinarene: a very high packing coefficient in a mono-anion based dimeric capsule and the X-ray crystal structure of the tetra-anion

Mono- and tetra-deprotonated 2-methylresorcinarene anions ( 1 and 2 ) as their trans -1,4-diammoniumcyclohexane (TDAC) 2+ inclusion complexes are reported. The mono-anion forms a fully closed dimeric capsule [ 1 ·H 2 O·MeOH] 2 2− with a cavity volume of 165 3 and (TDAC) 2+ as the guest with an extre...

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Veröffentlicht in:Chemical communications (Cambridge, England) England), 2016-06, Vol.52 (52), p.8115-8118
Hauptverfasser: Puttreddy, Rakesh, Beyeh, Ngong Kodiah, Kalenius, Elina, Ras, Robin H. A, Rissanen, Kari
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Sprache:eng
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Zusammenfassung:Mono- and tetra-deprotonated 2-methylresorcinarene anions ( 1 and 2 ) as their trans -1,4-diammoniumcyclohexane (TDAC) 2+ inclusion complexes are reported. The mono-anion forms a fully closed dimeric capsule [ 1 ·H 2 O·MeOH] 2 2− with a cavity volume of 165 3 and (TDAC) 2+ as the guest with an extremely high packing coefficient, PC = 84.2%, while the tetra-anion forms a close-packed structure with two structurally isomeric tetra-anions 2a and 2b with a 50 : 50 ratio in the crystal lattice. Mono- and tetra-deprotonated 2-methylresorcinarene anions ( 1 and 2 ) as their trans -1,4-diammoniumcyclohexane (TDAC) 2+ inclusion complexes are reported.
ISSN:1359-7345
1364-548X
DOI:10.1039/c6cc03289c