Geometry & MOs

Info

ID:	70624
PubChem CID:	48413609
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	419.19574
ΔH_f, kcal/mol:	-38.15
Dipole, Da:	5.59
IP(EA), eV:	-8.84(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC(=O)NC(C2=NC(=NO2)C3=CC=CC=C3)C(C)C)OC

DOS

IR

Vibrations