Geometry & MOs

Info

ID:	5652
PubChem CID:	13439
Reduced:	NSH9C13 (1)
Stoich.:	ABC9D13 (1)
Weight, g/mol:	211.04557
ΔH_f, kcal/mol:	73.53
Dipole, Da:	0.86
IP(EA), eV:	-9.05(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-1,3-benzothiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations