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Новосибирский институт органической химии им. Н.Н. Ворожцова СО РАН

Лаборатория изучения механизмов органических реакций

Diens

Methods of conformational anlysis: MM (Tinker scan + Vconf)
Energy by MOPAC2012 (PM7 hamiltonian)

On figure(s) below click on the level title to download xyz file ==>
Click on energy level to view 3D structure in browser (run JSmol) ==>

0.00 0.00 0.38 0.38 3.58 3.58 3.87 3.87 4.03 4.03 4.04 4.04 4.97 4.97 5.16 5.16 7.68 7.68 11.10 11.10 11.27 11.27 11.64 11.64 12.24 12.24 14.72 14.72 16.68 16.68 16.81 16.81