Geometry & MOs

Info

ID:	250280
PubChem CID:	103095321
Reduced:	ClOSN2C10H11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	272.071641
ΔH_f, kcal/mol:	28.68
Dipole, Da:	2.68
IP(EA), eV:	-9.35(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloropropyl)-5-naphthalen-1-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)CC2=CC=CS2)Cl

DOS

IR

Vibrations