Geometry & MOs

Info

ID:	202543
PubChem CID:	79683152
Reduced:	SO2N4C8H12 (1)
Stoich.:	AB2C4D8E12 (1)
Weight, g/mol:	189.045964
ΔH_f, kcal/mol:	-30.05
Dipole, Da:	1.3
IP(EA), eV:	-9.45(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,2-oxazol-4-ylmethylsulfanyl)propane-1,2-diol

Drug info:

PubChemData

Smile

C1=C(N=CC(=N1)SCC(CO)O)C(=N)N

DOS

IR

Vibrations