Geometry & MOs

Info

ID:	142979
PubChem CID:	53125987
Reduced:	SN3O3C18H19 (1)
Stoich.:	AB3C3D18E19 (1)
Weight, g/mol:	364.142307
ΔH_f, kcal/mol:	-24.91
Dipole, Da:	4.5
IP(EA), eV:	-8.91(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,4-dimethoxyphenyl)methyl]-3-(3,5-dimethyl-1-benzofuran-2-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(=O)NCC1=CC=C(S1)C2=NOC(=N2)CCC3=CC=C(C=C3)OC

DOS

IR

Vibrations