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17,18-Dibromo-8-methyl-4,12-ditosyl-3,4,5,6,7,8,9,10,11,12,13,14-dodeca-hydro-2H-benzo[b][1,4,7,11,15]dioxatriaza-cyclo-hepta-decine.

ABSTRACT: In the title compound, C(31)H(39)Br(2)N(3)O(6)S(2), a 17-membered aza-macrocyclic ligand containing two ether O and three aza N atoms, the three pendant aromatic rings form an 'E' shape. The dihedral angles between the central benzene ring and the side ones are 17.8?(3) and 7.4?(3)°, and the dihedral angle between the tosyl rings is 10.6?(3)°. The methyl group is disordered over two orientations, with occupancies of 0.52?(15) and 0.48?(15).

SUBMITTER: Kelesoglu Z 

PROVIDER: S-EPMC2979080 | biostudies-other | 2010

REPOSITORIES: biostudies-other

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17,18-Dibromo-8-methyl-4,12-ditosyl-3,4,5,6,7,8,9,10,11,12,13,14-dodeca-hydro-2H-benzo[b][1,4,7,11,15]dioxatriaza-cyclo-hepta-decine.

Keleşoğlu Zeynep Z   Celenk Kaya Elif E   Kantekin Halit H   Büyükgüngör Orhan O  

Acta crystallographica. Section E, Structure reports online 20100414 Pt 5

In the title compound, C(31)H(39)Br(2)N(3)O(6)S(2), a 17-membered aza-macrocyclic ligand containing two ether O and three aza N atoms, the three pendant aromatic rings form an 'E' shape. The dihedral angles between the central benzene ring and the side ones are 17.8 (3) and 7.4 (3)°, and the dihedral angle between the tosyl rings is 10.6 (3)°. The methyl group is disordered over two orientations, with occupancies of 0.52 (15) and 0.48 (15). ...[more]

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