| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 9629182 | Fuel | 2005 | 11 Pages |
Abstract
The average structure of organic substances contained in Barzas coal has been constructed by means of a commercial molecular modelling package on the basis of kinetic investigations and structural group analysis of high-molecular products obtained by the process of coal non-isothermal liquefaction in a proton-donor solvent. This model structure has been optimized geometrically by minimization of its conformational energy. The established model structure corresponds to the mean formula C727H790N2S4O36 and to a molecular weight of 10,260Â g/mol (amu).
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Physical Sciences and Engineering
Chemical Engineering
Chemical Engineering (General)
Authors
Yu. F. Patrakov, V.F. Kamyanov, O.N. Fedyaeva,