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Sulfur rings containing other elements

In this connection, a very recent paper by Allinger (8) should be mentioned. A force field has been developed to permit molecular mechanics calculations on various molecular structures of elemental sulfur. The conformational characteristics of sulfur rings containing five to 12, 14, 16, 18, or 20 sulfur atoms have been examined. Comparison with experimental data is made in all cases where such data exist, and predictions are made for other cases. Ab initio molecular orbital calculations using an STO-3G basis set were carried out for cyclohexasulfur and are consistent with the molecular mechanics calculations in indicating that the chair and the twist forms are two stable conformations, with the chair about 15 kcal/mol more stable while the boat (C2t,) is a twist rotational transition state. Calculation of possible conformations of the pro-... [Pg.18]

Heterocyclic compounds make up the third and largest class of molecular frameworks for organic compounds. In heterocyclic compounds, at least one atom in the ring must be a heteroatom, an atom that is not carbon. The most common heteroatoms are oxygen, nitrogen, and sulfur, but heterocyclics with other elements are also known. More than one heteroatom may be present and, if so, the heteroatoms may be alike or different. Heterocyclic rings come in many sizes, may contain multiple bonds, may have... [Pg.28]

Some other elements exist as more complex molecules. One form of phosphorus molecules consists of four atoms, and sulfur exists as eight-atom ring-shaped molecules at ordinary temperatures and pressures. Molecules that contain two or more atoms are called polyatomic moXtoAts (Figure 1-4). [Pg.7]


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See also in sourсe #XX -- [ Pg.306 , Pg.307 ]




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