Geometry & MOs

Info

ID:	152368
PubChem CID:	56311283
Reduced:	Cl2O2N3C22H25 (1)
Stoich.:	A2B2C3D22E25 (1)
Weight, g/mol:	469.236542
ΔH_f, kcal/mol:	-71.66
Dipole, Da:	0.73
IP(EA), eV:	-9.06(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations