Geometry & MOs

Info

ID:	250281
PubChem CID:	103095324
Reduced:	ClON2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	202.087291
ΔH_f, kcal/mol:	46.63
Dipole, Da:	3.59
IP(EA), eV:	-9.27(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-3-(1-chloropropyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)C2=CC=CC3=CC=CC=C32)Cl

DOS

IR

Vibrations