Geometry & MOs

Info

ID:	35702
PubChem CID:	7980220
Reduced:	ClN2O4H13C17 (1)
Stoich.:	AB2C4D13E17 (1)
Weight, g/mol:	300.074621
ΔH_f, kcal/mol:	-59.8
Dipole, Da:	3.66
IP(EA), eV:	-9.27(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-phenoxyacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations