Geometry & MOs

Info

ID:	26392
PubChem CID:	646048
Reduced:	N4H16C19 (1)
Stoich.:	A4B16C19 (1)
Weight, g/mol:	220.030649
ΔH_f, kcal/mol:	107.86
Dipole, Da:	3.61
IP(EA), eV:	-8.28(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-oxo-1,3-benzothiazin-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NN2C(NC3=CC=CC=C3C2=C1)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations