Geometry & MOs

Info

ID:	268270
PubChem CID:	103598669
Reduced:	ClON4C21H25 (1)
Stoich.:	ABC4D21E25 (1)
Weight, g/mol:	306.111676
ΔH_f, kcal/mol:	22.92
Dipole, Da:	4.21
IP(EA), eV:	-8.24(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-3-pyridin-4-ylprop-2-enamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCCNC(=O)C=CC2=CC=CC=N2)C3=CC=CC=C3Cl

DOS

IR

Vibrations