Geometry & MOs

Info

ID:	250315
PubChem CID:	103095619
Reduced:	ClON4C10H13 (1)
Stoich.:	ABC4D10E13 (1)
Weight, g/mol:	258.113506
ΔH_f, kcal/mol:	34.11
Dipole, Da:	5.58
IP(EA), eV:	-9.66(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)C2=C(N(N=C2)C)C)Cl

DOS

IR

Vibrations