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A triazine derivative with a triple-decker sandwich conformation

✍ Scribed by Peter, Xolani K. ;Heerden, Fanie R. van ;Munro, Orde Q.


Book ID
104489225
Publisher
International Union of Crystallography
Year
2007
Tongue
English
Weight
292 KB
Volume
63
Category
Article
ISSN
1600-5368

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✦ Synopsis


In dimethyl 3,3 0 -[6-methoxy-1,3,5-triazine-2,4-diyl)bis(oxy)]bis(4-benzyloxy-5-methoxybenzoate), C 36 H 33 N 3 O 11 , a new triazine derivative, the benzyloxy groups adopt an interesting conformation in which they are positioned above and below the triazine ring 'core' of the molecule to form an intramolecular triple-decker sandwich. The ester carbonyl O atoms of adjacent molecules in the crystal structure participate in non-conventional (alkyl)C-HÁ Á ÁO hydrogen bonds [averaging 2.45 (1)A ˚] about an inversion centre to give a weakly hydrogen-bonded dimer.


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V=6213(7)AZ. Z = 4. , I ~, , , ~~ = l.l6X A total of 12975 unique data points Nere collected (Mo,,. i = 0.71049 A, p =1.60cm-'. 20<50-) of which 4386 had F>4u(k') and werc used for structure retinement Thete data bets were collected by using a Rigaku AFC-5R diffractometer at 296 K. An absorption co