Geometry & MOs

Info

ID:	393769
PubChem CID:	135021667
Reduced:	SO2C9H10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	248.13472
ΔH_f, kcal/mol:	43.5
Dipole, Da:	10.42
IP(EA), eV:	-7.77(-3.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-pentyl-4H-1,3-benzothiazin-2-imine

Drug info:

PubChemData

Smile

C[CH]C1=CS(=O)(=O)C=C1[CH]C=C

DOS

IR

Vibrations