Geometry & MOs

Info

ID:	152138
PubChem CID:	56311003
Reduced:	O2N5C28H35 (1)
Stoich.:	A2B5C28D35 (1)
Weight, g/mol:	441.226371
ΔH_f, kcal/mol:	-26.32
Dipole, Da:	3.79
IP(EA), eV:	-8.94(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NCC3=C(N(N=C3C)CC4=CC=CC=C4)C

DOS

IR

Vibrations