Geometry & MOs

Info

ID:	444606
PubChem CID:	135263013
Reduced:	SN3O4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	283.051444
ΔH_f, kcal/mol:	-142.64
Dipole, Da:	1.89
IP(EA), eV:	-9.65(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methyl-2,2-dioxo-4,2lambda6,1-benzoxathiazin-6-yl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1CC(=O)O)N2CCS(=O)(=O)CC2

DOS

IR

Vibrations