Geometry & MOs

Info

ID:	250285
PubChem CID:	103095336
Reduced:	OCl2N2C12H12 (1)
Stoich.:	AB2C2D12E12 (1)
Weight, g/mol:	242.028062
ΔH_f, kcal/mol:	12.95
Dipole, Da:	3.92
IP(EA), eV:	-9.77(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)CC2=CC=CC=C2Cl)Cl

DOS

IR

Vibrations