Geometry & MOs

Info

ID:	157554
PubChem CID:	56435674
Reduced:	Cl2O3N4C18H20 (1)
Stoich.:	A2B3C4D18E20 (1)
Weight, g/mol:	403.16444
ΔH_f, kcal/mol:	-75.49
Dipole, Da:	2.8
IP(EA), eV:	-9.73(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCNC(=O)C2CCCN2C(=O)C3=C(C=CC(=C3)Cl)Cl

DOS

IR

Vibrations