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This book covers a range of new research on computational quantum
chemistry, along with a special section devoted to exotic carbon
allotropes and spiro quantum theory. The section on spiro quantum
theory covers the technical presentation of the ideas surrounding
the emergence of a synthetic, analytical, and theoretical spiro
quantum chemistry edifice, as well as a chemical topology scheme
that successfully describes molecules and patterns, including the
hydrocarbons and allotropes of carbon. The second part of the book
covers a range of new research on computational quantum chemistry.
Spiro Quantum Chemistry is a popular as well as technical
presentation of the ideas surrounding the emergence of a synthetic,
analytical, and theoretical spiro quantum chemistry edifice, as
well as a chemical topology scheme that successfully describes
molecules and patterns, including the hydrocarbons and allotropes
of carbon. In particular, the purpose of this book is to describe
the generalization and realization of the organic chemistry concept
of spiroconjugation into 1-, 2- and 3-dimensions. The book is
divided into three parts: The first part describes spiroconjugation
and presents a C lattice that exhibits the spiroconjugation
phenomena in fully 3-dimensions. It also described the
corresponding 1-dimensional substructures of this lattice that
exhibit spiroconjugation delocalized in 1-D. The second part
presents experimental evidence for the synthetic realization of
this so-called glitter allotrope of C that is spiroconjugated in
3-D, and present evidence why this synthetically realized C
allotrope has a metallic status. The third part describes the
chemical topology of the glitter C allotrope and of the other
commonly known allotropes of C.This chemical topology enables one
to map the C allotropes, including glitter, in a topology space
allowing one to classify them. This unique book provides insights
into the potential richness of organic chemistry in terms of a
source of a metallic allotrope of C. The reader will learn to
appreciate the generalization of the spiroconjugation phenomenon in
1-D, 2-D, and 3D as a concept in organic chemistry.
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