Geometry & MOs

Info

ID:	236434
PubChem CID:	92712925
Reduced:	N3O5H17C21 (1)
Stoich.:	A3B5C17D21 (1)
Weight, g/mol:	348.087685
ΔH_f, kcal/mol:	-28.68
Dipole, Da:	10.03
IP(EA), eV:	-8.82(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-[(4-chloro-2-methylphenoxy)methyl]-5-(5-methylfuran-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](OC(=N1)C2=CC=C(C3=CC=CC=C32)OC)C4=CC(=CC=C4)[N+](=O)[O-]

DOS

IR

Vibrations