A theoretical investigation of the isomers of diazomethane (CH2N2). II. One-electron properties

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Abstract
Use has been made of calculated one-electron properties to gain a better understanding of the electronic structure of five related molecules, the isomers of diazomethane. Localized exclusive orbitals have been used to assist in the interpretation of 14N quadrupole coupling constants and the total dipole moment associated with each molecule.

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