5,11,17,23,29,35-Hexa-tert -butyl-37,38,39,40,41,42-hexakis-(ethoxycarbonylmethoxy)calix[6]arene acetonitrile disolvate
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F68378271%3A_____%2F12%3A00382405" target="_blank" >RIV/68378271:_____/12:00382405 - isvavai.cz</a>
Result on the web
<a href="http://dx.doi.org/10.1107/S1600536812015735" target="_blank" >http://dx.doi.org/10.1107/S1600536812015735</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1107/S1600536812015735" target="_blank" >10.1107/S1600536812015735</a>
Alternative languages
Result language
angličtina
Original language name
5,11,17,23,29,35-Hexa-tert -butyl-37,38,39,40,41,42-hexakis-(ethoxycarbonylmethoxy)calix[6]arene acetonitrile disolvate
Original language description
In the title compound, C90H120O18 .2C3HCN, the calix[6]arene has a 1,2,3-alternate conformation and possesses inversion symmetry. It crystallizes as an acetonitrile disolvate, with a half-molecule of calix[6]arene and one molecule of solvent in the asymmetric unit. In the crystal, the two solvent molecules are enclosed in voids between the calix[6]arene molecules. They form weak C?H ... O hydrogen bonds involving an O atom of the lower rim substituent. The cavity of the calix[6]arene itself is enclosedby two opposite phenol rings, which are turned into the cavity due to the presence of a C? H...? interaction. The calix[6]arene molecule exhibits disorder of one substituent on its lower rim [occupancy ratio 0.897 (3):0.103 (3)].
Czech name
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Czech description
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Classification
Type
J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)
CEP classification
BM - Solid-state physics and magnetism
OECD FORD branch
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Result continuities
Project
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Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)
Others
Publication year
2012
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Acta Crystallographica section E - Structure Reports Online
ISSN
1600-5368
e-ISSN
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Volume of the periodical
68
Issue of the periodical within the volume
5
Country of publishing house
DK - DENMARK
Number of pages
13
Pages from-to
"o1418"-"sup13"
UT code for WoS article
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EID of the result in the Scopus database
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