Geometry & MOs

Info

ID:	347976
PubChem CID:	127273038
Reduced:	SO2N4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	361.236542
ΔH_f, kcal/mol:	-66.34
Dipole, Da:	1.81
IP(EA), eV:	-8.25(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[2-(4-methylpiperazin-1-yl)propyl]acetamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CN1C(=O)CSC2=CC=CC=C21)N3CCN(CC3)C

DOS

IR

Vibrations