Geometry & MOs

Info

ID:	27722
PubChem CID:	823277
Reduced:	ClSO3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	306.09258
ΔH_f, kcal/mol:	-112.57
Dipole, Da:	2.17
IP(EA), eV:	-8.92(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-3-[(4-phenoxyphenyl)methylsulfinyl]propane-1,2-diol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CS(=O)C[C@@H](CO)O)Cl

DOS

IR

Vibrations