Geometry & MOs

Info

ID:	347975
PubChem CID:	127273037
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	362.177647
ΔH_f, kcal/mol:	-152.1
Dipole, Da:	5.67
IP(EA), eV:	-8.44(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperazin-1-yl)propyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CCN1C(=O)C2CCCCC2C1=O)N3CCN(CC3)C

DOS

IR

Vibrations