Geometry & MOs

Info

ID:	304472
PubChem CID:	124753004
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	348.216141
ΔH_f, kcal/mol:	-113.96
Dipole, Da:	4.28
IP(EA), eV:	-8.5(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-2-[4-[(3S)-pyrrolidin-3-yl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN1C[C@H](OCC1=O)CNC(=O)C2=CC=C(C=C2)N3CCCCC3

DOS

IR

Vibrations