Publication Type Journal Article
Title A new conformer of 1,4,7-tris(p-tolylsulfonyl)-1,4,7-triazacyclononane
Authors Vânia André Sonia Barroso Ana M. Martins M. Teresa Duarte
Groups BioMol IOARC
Journal ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS
Year 2007
Month October
Volume 63
Number 10
Pages O594-O596
Abstract A second polymorphic form ( form II) of the previously reported 1,4,7- tris( p- tolylsulfonyl)- 1,4,7- triazacyclononane ( form I), C27H33N3O6S3, is presented. The molecular structures of the two forms display very different conformations, thus prompting the two forms to crystallize in two different space groups and exhibit quite diverse crystal structure assemblies. Form I crystallizes in the triclinic space group P (1) over bar, while form II crystallizes in the monoclinic space group P2(1)/ n. The main differences between the two molecular structures are the conformations of the p- tosyl groups relative to each other and to the macrocyclic ring. The resulting crystal packing displays no classical hydrogen bonds, but different supramolecular synthons give rise to different packing motifs.
DOI http://dx.doi.org/10.1107/S010827010703805X
ISBN
Publisher WILEY-BLACKWELL
Book Title
ISSN 0108-2701
EISSN
Conference Name
Bibtex ID ISI:000249921600028
Observations
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