Geometry & MOs

Info

ID:	174627
PubChem CID:	75796905
Reduced:	SN2O4C13H14 (1)
Stoich.:	AB2C4D13E14 (1)
Weight, g/mol:	334.122538
ΔH_f, kcal/mol:	-157.03
Dipole, Da:	7.54
IP(EA), eV:	-9.27(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-methyl-3-oxo-N-(piperidin-1-ium-4-carbonyl)-4H-1,4-benzothiazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)O)NC(=O)C1(C(=O)NC2=CC=CC=C2S1)C

DOS

IR

Vibrations