Geometry & MOs

Info

ID:	57666
PubChem CID:	22431818
Reduced:	ClO2N3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	351.158292
ΔH_f, kcal/mol:	-36.64
Dipole, Da:	2.41
IP(EA), eV:	-9.72(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-methoxyphenyl)methyl]-N-[2-(4-methylphenyl)ethyl]-1,3,4-oxadiazole-2-carboxamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)C2=NN=C(O2)CC3=CC(=CC=C3)Cl

DOS

IR

Vibrations