Geometry & MOs

Info

ID:	68461
PubChem CID:	46508459
Reduced:	ON2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	423.158292
ΔH_f, kcal/mol:	-6.29
Dipole, Da:	5.73
IP(EA), eV:	-9.4(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-benzofuran-2-yl)ethyl]-4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)C(C(C)C)NC(=O)CCC2=NC(=NO2)C3=CC=NC=C3

DOS

IR

Vibrations