Geometry & MOs

Info

ID:	250361
PubChem CID:	103095995
Reduced:	ClSN2O3C13H15 (1)
Stoich.:	ABC2D3E13F15 (1)
Weight, g/mol:	286.181191
ΔH_f, kcal/mol:	-58.64
Dipole, Da:	5.0
IP(EA), eV:	-10.35(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chlorobutyl)-5-nonyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCCC(C1=NOC(=N1)C2=CC(=CC=C2)S(=O)(=O)C)Cl

DOS

IR

Vibrations