Geometry & MOs

Info

ID:	329905
PubChem CID:	127246772
Reduced:	OSN3C17H21 (1)
Stoich.:	ABC3D17E21 (1)
Weight, g/mol:	339.194677
ΔH_f, kcal/mol:	11.84
Dipole, Da:	5.7
IP(EA), eV:	-8.46(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]-2-(3-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

CN(C)C1=NC=CC(=C1)C2CCCN2C(=O)CC3=CC=CS3

DOS

IR

Vibrations