Geometry & MOs

Info

ID:	38771
PubChem CID:	8137900
Reduced:	N4O5C21H24 (1)
Stoich.:	A4B5C21D24 (1)
Weight, g/mol:	405.168856
ΔH_f, kcal/mol:	-98.07
Dipole, Da:	1.7
IP(EA), eV:	-8.89(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pentyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NOC(=N2)CCCCCNC(=O)CNC(=O)C3=CC=CO3

DOS

IR

Vibrations