WINDAT - AN NMR DATABASE COMPILATION TOOL, USER-INTERFACE, AND SPECTRUM LIBRARIES FOR PERSONAL COMPUTERS

A fast, efficient program which runs on the ubiquitous personal comput er for the analysis, storage, and retrieval of NMR information is pres ented. It is suitable for abstracting large quantities of data from pu blished literature and includes many plausibility tests which are Exec uted simultaneously with the input. Automatic determination of stereoc onfigurations in 2D structures; makes the program of great value for n atural compounds. A structure elucidation system allows prediction che mical shifts and JJ coupling constants and automatic peak assignation. A database of 101 205 C-13, P-31, F-19, Si-29, N-15, B-11, O-17, and S-33 spectra, taken primarily from Russian-language original sources h as been created.