Geometry & MOs

Info

ID:	22273
PubChem CID:	596481
Reduced:	OSN2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	206.051384
ΔH_f, kcal/mol:	-12.96
Dipole, Da:	3.12
IP(EA), eV:	-8.75(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-1,3-benzothiazol-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C

DOS

IR

Vibrations