Новосибирский институт органической химии им. Н.Н. Ворожцова СО РАН
Лаборатория изучения механизмов органических реакций
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Conformational analysis of cis- and trans- 3,8-bis-(4-hydroxyphenyl)-2,2-dimethyl-1,4-diazaspiro[4,5]dec-3-en-1-ol
Methods of conformational anlysis:Marvin conformers + VeraChem Vconf + Confab — MOPAC2012 (RM1) — DFT (PRIRODA).Energy (without ZPE) by DFT/PBE/L22 (cc-pCVTZ) for DFT/PBE/L1 (cc-pVDZ) geometry (PRIRODA program).
