Geometry & MOs

Info

ID:	38770
PubChem CID:	8137898
Reduced:	NO2C9H9 (2)
Stoich.:	AB2C9D9 (2)
Weight, g/mol:	412.17467
ΔH_f, kcal/mol:	-69.29
Dipole, Da:	4.18
IP(EA), eV:	-9.27(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pentylamino]-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=C(OC(=C3)C)C

DOS

IR

Vibrations