Geometry & MOs

Info

ID:	152157
PubChem CID:	56311025
Reduced:	O2N3C26H37 (1)
Stoich.:	A2B3C26D37 (1)
Weight, g/mol:	425.231456
ΔH_f, kcal/mol:	-110.9
Dipole, Da:	4.09
IP(EA), eV:	-8.98(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethoxyphenyl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)C(C)C(=O)NC34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations