Ontology highlight
ABSTRACT:
SUBMITTER: Resch S
PROVIDER: S-EPMC4555377 | biostudies-literature | 2015 Sep
REPOSITORIES: biostudies-literature
Acta crystallographica. Section E, Crystallographic communications 20150822 Pt 9
The hetero-tetra-cene skeleton of the title mol-ecule, C23H14Br2N2OS, is defined by linear annulation of four six-membered rings, including two N heteroatoms. This moiety is nearly planar (r.m.s. deviation = 0.055 Å), with a slight twist of 4.1 (2)° between the two halves of the aromatic system. The dihedral angle between the least-squares plane of the skeleton and the benzyl group is 24.5 (3)°; the C-S-C angle involving the benzyl-sulfanyl group is 99.2 (4)°. In the crystal, mol-ecules are π-st ...[more]