Geometry & MOs

Info

ID:	250429
PubChem CID:	103096509
Reduced:	SN2O4C9H16 (1)
Stoich.:	AB2C4D9E16 (1)
Weight, g/mol:	239.072848
ΔH_f, kcal/mol:	-129.78
Dipole, Da:	6.03
IP(EA), eV:	-10.94(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(4-methyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]butan-1-ol

Drug info:

PubChemData

Smile

CCCC(C1=NOC(=N1)C(C)S(=O)(=O)C)O

DOS

IR

Vibrations