Geometry & MOs

Info

ID:	85789
PubChem CID:	49879150
Reduced:	FON5H20C21 (1)
Stoich.:	ABC5D20E21 (1)
Weight, g/mol:	270.046299
ΔH_f, kcal/mol:	31.79
Dipole, Da:	8.56
IP(EA), eV:	-8.94(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-oxo-3H-1,3-benzothiazol-6-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NC2=NC(=NN2C(=C1)NCC3=CC=CC=C3OC)CC4=CC(=CC=C4)F

DOS

IR

Vibrations