Geometry & MOs

Info

ID:	151820
PubChem CID:	56310633
Reduced:	N2O2C11H13 (2)
Stoich.:	A2B2C11D13 (2)
Weight, g/mol:	417.186398
ΔH_f, kcal/mol:	-58.34
Dipole, Da:	4.63
IP(EA), eV:	-9.29(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(difluoromethoxy)phenyl]-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C

DOS

IR

Vibrations