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Hydrocarbon links in an octet truss
Authors:Mary?A?Cox  Thomas?S?Hughes  Email author" target="_blank">Joanna?A?Ellis-MonaghanEmail author  Kathleen?R?Mondanaro
Institution:(1) Department of Mathematics and Statistics, University of Vermont, Burlington, VT 05405, USA;(2) Department of Chemistry, University of Vermont, Burlington, VT 05405, USA;(3) Department of Mathematics, Saint Michael’s College, One Winooski Park, Colchester, VT 05439, USA;(4) Department of Chemistry, Saint Michael’s College, One Winooski Park, Colchester, VT 05439, USA
Abstract:We use the octet truss of R. Buckminster Fuller to develop a geometric placement method for synthesizing braid representations of knots and links of oligo (phenylene ethynylene)s using the 60° ortho, 120° meta or 180° para phenyl ring substitution angles and respecting the van der Waals repulsion constraints. We show that any knot or link can be realized by a phenylene ethynylene oligomer modeled on the octet truss. Use of this lattice is motivated by the structural constraints of these phenylene ethynylene units. Where in bio-organic chemistry, questions often involve identifying existing knots, for example in DNA strands, organic synthesis is concerned with assembling molecular structures that can be verified to exist in a desired knot topology. This physical realization of a knot as a construction of common organic molecular subunits then facilitates further study of the properties of knotted molecules in general.
Keywords:Knot  Link  Braid  Octahedron  Tetrahedron  Equiangular  Octet truss  Phenylene ethynylene  Equilateral
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