Determination of the structure of 2(benzene-1,3,5-tricarboxylic acid)center dot 1.5(pyrene)center dot 2(methanol) and comparison with that of 2(benzene-1,3,5-tricarboxylic acid)center dot pyrene center dot 2(ethanol)

Citation
Fh. Herbstein et al., Determination of the structure of 2(benzene-1,3,5-tricarboxylic acid)center dot 1.5(pyrene)center dot 2(methanol) and comparison with that of 2(benzene-1,3,5-tricarboxylic acid)center dot pyrene center dot 2(ethanol), ACT CRYST B, 57, 2001, pp. 692-696
Citations number
19
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE
ISSN journal
01087681 → ACNP
Volume
57
Year of publication
2001
Part
5
Pages
692 - 696
Database
ISI
SICI code
0108-7681(200110)57:<692:DOTSO2>2.0.ZU;2-H
Abstract
The structure of the title methanol complex (P (1) over bar, Z = 2) has bee n determined and compared with that of the title ethanol complex (C2/c, Z = 8) using published data. Both complexes have layer structures, the (essent ially planar) layers being constructed from rings of six TMA molecules, hyd rogen bonded through four 'carboxyl dimers' and two 'interrupted dimers', w here methanol (ethanol) is included in the R-4(4)(12) (graph set) ring. The packing of the layers differs in the two complexes, leading to different t hree-dimensional structures. In the methanol complex, one pyrene molecule i s located within the layer and the other, at a centre of symmetry, between the layers in one type of interlayer space, while the methyls of methanol p rotrude into the other type of interlayer space. In the ethanol complex, th e superpositioning of the layers is such that two types of stack are formed ; one of these is mixed, containing pyrene and one of the independent TMA m olecules in alternating sequence, while the other stack contains only the s econd type of TMA. Spectroscopic study is needed to establish whether the p artial mixed stack arrangement in the crystalline ethanol complex implies d onor-acceptor interaction.