Geometry & MOs

Info

ID:	55967
PubChem CID:	17397940
Reduced:	N2S2O4C23H30 (1)
Stoich.:	A2B2C4D23E30 (1)
Weight, g/mol:	328.088164
ΔH_f, kcal/mol:	-132.3
Dipole, Da:	7.58
IP(EA), eV:	-9.24(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations