A comparison of 2,7-dihydro-2,2,7,7-tetramethyl-3,6-diphenyl-1,4,5-thiadiazepine and the corresponding 1,1-dioxide

Acta Crystallogr C. 2001 Apr;57(Pt 4):431-2. doi: 10.1107/s0108270100020564.

Abstract

The structures of the highly substituted title heterocycles, C(20)H(22)N(2)S and C(20)H(22)N(2)O(2)S, have been determined at 123 (1) K. Both molecules possess exact C(2) symmetry and the seven-membered rings have very similar twist-boat conformations. The magnitudes of the C-S-C bond angles, 107.13 (6) and 108.27 (7) degrees, respectively, are influenced significantly by the four substituent methyl groups on the seven-membered rings.