Geometry & MOs

Info

ID:	152565
PubChem CID:	56311522
Reduced:	N3O4C26H33 (1)
Stoich.:	A3B4C26D33 (1)
Weight, g/mol:	438.226705
ΔH_f, kcal/mol:	-122.48
Dipole, Da:	5.01
IP(EA), eV:	-8.3(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-acetamido-2-methoxyphenyl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

DOS

IR

Vibrations