Geometry & MOs

Info

ID:	2749
PubChem CID:	8446
Reduced:	NSH7C8 (1)
Stoich.:	ABC7D8 (1)
Weight, g/mol:	149.02992
ΔH_f, kcal/mol:	38.71
Dipole, Da:	0.97
IP(EA), eV:	-9.06(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1,3-benzothiazole

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2S1

DOS

IR

Vibrations