Geometry & MOs

Info

ID:	247717
PubChem CID:	103072935
Reduced:	SN2O2C10H16 (1)
Stoich.:	AB2C2D10E16 (1)
Weight, g/mol:	248.061949
ΔH_f, kcal/mol:	-81.81
Dipole, Da:	2.25
IP(EA), eV:	-9.04(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(aminomethyl)prop-2-enyl]-1,3-benzothiazine-2,4-dione

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C(=O)CCSC1=O

DOS

IR

Vibrations