Geometry & MOs

Info

ID:	250321
PubChem CID:	103095669
Reduced:	ClON2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	258.037147
ΔH_f, kcal/mol:	12.86
Dipole, Da:	2.87
IP(EA), eV:	-9.77(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloropropyl)-5-(2,5-difluorophenyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)C2=NC(=NO2)C(CC)Cl

DOS

IR

Vibrations