Geometry & MOs

Info

ID:	38772
PubChem CID:	8137904
Reduced:	N3O4C23H23 (1)
Stoich.:	A3B4C23D23 (1)
Weight, g/mol:	330.101585
ΔH_f, kcal/mol:	-39.37
Dipole, Da:	3.14
IP(EA), eV:	-8.88(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-1-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2,5-dimethylfuran-3-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NOC(=N2)CCCCCNC(=O)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations