Geometry & MOs

Info

ID:	306735
PubChem CID:	125236549
Reduced:	N2O3C20H28 (1)
Stoich.:	A2B3C20D28 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	-129.71
Dipole, Da:	3.41
IP(EA), eV:	-8.69(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aS,7S,7aS)-2-(pyridin-2-ylmethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrol-7-yl]-1-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

CCN1CCC2(CC1)C[C@@H](C3=CC=CC=C3O2)NC(=O)[C@@H]4CCCO4

DOS

IR

Vibrations