Geometry & MOs

Info

ID:	329908
PubChem CID:	127246775
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-58.02
Dipole, Da:	5.36
IP(EA), eV:	-8.41(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-benzodioxol-5-yl-[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN(C)C1=NC=CC(=C1)C2CCCN2C(=O)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations