Geometry & MOs

Info

ID:	346273
PubChem CID:	127270777
Reduced:	SO2N4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	361.146013
ΔH_f, kcal/mol:	-66.96
Dipole, Da:	5.74
IP(EA), eV:	-9.14(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide

Drug info:

PubChemData

Smile

CC(C1=NC2=CC=CC=C2N1)SCC(=O)NC3CCN(CC3)C(=O)C

DOS

IR

Vibrations