作者: F. R. Ahmed , E. J. Gabe
DOI: 10.1107/S0365110X64001360
关键词: Hexane 、 Monoclinic crystal system 、 Crystal 、 Bromine 、 Bromide 、 Crystallography 、 Materials science 、 Molecule 、 Hydrogen bond 、 Ring (chemistry)
摘要: Crystals of 6,6-diphenyl-3,3-diethyl-3-azabicyclo[3.1.0]hexane bromide monohydrate are monoclinic, space group P21/n with a = 12.044, b 17.598, c--9.137 J~; fl 95 ° 44'. The structure has been determined from Patterson and Fourier syntheses employing 3611 observed reflexions measured on counter diffractometer. final atomic parameters have obtained by obs. calc. differential syntheses, the hydrogen atoms located 3-D difference map. In this structure, five-membered ring its four carbon nearly, but not exactly, in one plane nitrogen atom at 0.534 A plane. three-membered forms nearly equilateral triangle side 1.520/~ is fused to through C(1)-C(5) bond an angle 65.0 mean C(1), C(2), C(4), C(5). One ethyl groups appears be disordered, occupying orientation more frequently than other. Hydrogen bonding indicated between unattached bromine oxygen water molecules.