Geometry & MOs

Info

ID:	137158
PubChem CID:	52160699
Reduced:	N3O4C25H25 (1)
Stoich.:	A3B4C25D25 (1)
Weight, g/mol:	222.046299
ΔH_f, kcal/mol:	-73.84
Dipole, Da:	6.79
IP(EA), eV:	-9.18(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-3-oxo-4H-1,4-benzothiazine-2-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1)N2C(=CC=N2)NC(=O)C3=CC(=O)OC4=C3C=CC(=C4)OC(C)C

DOS

IR

Vibrations