Geometry & MOs

Info

ID:	23136
PubChem CID:	602395
Reduced:	OSN2H16C21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	344.098334
ΔH_f, kcal/mol:	65.72
Dipole, Da:	1.94
IP(EA), eV:	-8.64(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-imino-1,3-benzothiazol-3-yl)-1-(4-phenylphenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CN3C4=CC=CC=C4SC3=N

DOS

IR

Vibrations