Geometry & MOs

Info

ID:	304049
PubChem CID:	124491702
Reduced:	ClO2N3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	307.108754
ΔH_f, kcal/mol:	-9.25
Dipole, Da:	1.52
IP(EA), eV:	-8.82(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloro-2-propoxyphenyl)-5-[(2R)-pyrrolidin-2-yl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)Cl)C2=NOC(=N2)[C@@H]3CCCN3

DOS

IR

Vibrations