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AB initio studies of a pentacyclo-undecane cage lactam Singh, Thishana Hartree-Fock approximation Chemistry--Dissertations, Academic Amino acids--Synthesis Molecular structure--Data processing Molecules--Models--Data processing Molecular structure--Computer simulation Submitted in fulfilment of the requirements for the Degree of Master of Technology: Chemistry, Durban Institute of Technology, Durban, South Africa, 2003. The purpose of this study is to utilize computational techniques in the determination of the mechanistic pathways for the one-pot conversion of a pentacyclo-undecane (PCU) dione 1.1 to a pentacyclo-undecane cage lactam 1.2. M 2008-03-13T12:50:34Z 2008-03-13T12:50:34Z 2003 Thesis DIT104126 http://hdl.handle.net/10321/237 https://doi.org/10.51415/10321/237 en 79 p application/pdf