Geometry & MOs

Info

ID:	127534
PubChem CID:	51005239
Reduced:	SO6C17H22 (1)
Stoich.:	AB6C17D22 (1)
Weight, g/mol:	540.076922
ΔH_f, kcal/mol:	-231.11
Dipole, Da:	4.98
IP(EA), eV:	-9.77(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2[C@@H]([C@H]([C@@H]3CO[C@H]2O3)CC(=C)C)O

DOS

IR

Vibrations