Geometry & MOs

Info

ID:	274443
PubChem CID:	103809404
Reduced:	OSN3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	269.062283
ΔH_f, kcal/mol:	-7.17
Dipole, Da:	3.11
IP(EA), eV:	-8.92(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1,3-benzothiazol-6-yl)benzamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC2=C(C=C1)N=CS2)CN

DOS

IR

Vibrations