Ⅰ. INTRODUCTION In this paper, fróm the molecular orbital graphical theory we have derived the closed formula of π-bond order and frontier charge density distribution of conjugated polyene and demonstrated the ...Ⅰ. INTRODUCTION In this paper, fróm the molecular orbital graphical theory we have derived the closed formula of π-bond order and frontier charge density distribution of conjugated polyene and demonstrated the connection between conjugated polyene bend order, frontier charge density and the molecular topology. The π-electron bond order展开更多
文摘Ⅰ. INTRODUCTION In this paper, fróm the molecular orbital graphical theory we have derived the closed formula of π-bond order and frontier charge density distribution of conjugated polyene and demonstrated the connection between conjugated polyene bend order, frontier charge density and the molecular topology. The π-electron bond order