Geometry & MOs

Info

ID:	356653
PubChem CID:	127292072
Reduced:	SO2N3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	382.1021
ΔH_f, kcal/mol:	-78.29
Dipole, Da:	3.37
IP(EA), eV:	-8.43(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzothiazin-4-yl)-N-(3-methyl-1,1-dioxothiolan-3-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)NC(=O)CCC(=O)N2CCSC3=CC=CC=C32

DOS

IR

Vibrations