Geometry & MOs

Info

ID:	390793
PubChem CID:	135000970
Reduced:	NSH9C13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	248.13472
ΔH_f, kcal/mol:	134.39
Dipole, Da:	1.84
IP(EA), eV:	-8.56(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-di(propan-2-yl)-2H-1,3-benzothiazin-2-amine

Drug info:

PubChemData

Smile

[CH]1[CH][CH][C]([CH]1)C2=CN=C(S2)[C]3[CH][CH][CH][CH]3

DOS

IR

Vibrations