Geometry & MOs

Info

ID:	306737
PubChem CID:	125236598
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-122.97
Dipole, Da:	3.26
IP(EA), eV:	-8.9(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S,3aS,6aR)-5-[(2-methoxypyridin-3-yl)methyl]-2,3,3a,4,6,6a-hexahydrofuro[2,3-c]pyrrol-2-yl]-1-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]2CN(CC[C@H]2O1)C(=O)CCOC3=CC=CC=C3

DOS

IR

Vibrations