Geometry & MOs

Info

ID:	152641
PubChem CID:	56311653
Reduced:	N4O4C21H28 (1)
Stoich.:	A4B4C21D28 (1)
Weight, g/mol:	407.257277
ΔH_f, kcal/mol:	-157.46
Dipole, Da:	2.85
IP(EA), eV:	-9.25(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)NC1)CN2CCN(CC2)C(=O)CC3=CC=CC=C3C

DOS

IR

Vibrations