Geometry & MOs

Info

ID:	250282
PubChem CID:	103095332
Reduced:	ClON2C9H15 (1)
Stoich.:	ABC2D9E15 (1)
Weight, g/mol:	188.071641
ΔH_f, kcal/mol:	-22.87
Dipole, Da:	3.13
IP(EA), eV:	-10.68(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)C(C)(C)C)Cl

DOS

IR

Vibrations