Geometry & MOs

Info

ID:	142605
PubChem CID:	53065427
Reduced:	N4O5H20C21 (1)
Stoich.:	A4B5C20D21 (1)
Weight, g/mol:	324.102254
ΔH_f, kcal/mol:	-80.39
Dipole, Da:	7.91
IP(EA), eV:	-8.63(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-6-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzimidazol-2-one

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C3=NOC(=N3)CC4=CC(=C(C=C4)OC)OC)NC(=O)C1=O

DOS

IR

Vibrations