Geometry & MOs

Info

ID:	32202
PubChem CID:	6435903
Reduced:	OC6H11 (2)
Stoich.:	AB6C11 (2)
Weight, g/mol:	422.171498
ΔH_f, kcal/mol:	-117.06
Dipole, Da:	1.62
IP(EA), eV:	-9.44(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

disodium;(Z,12R)-12-sulfonatooxyoctadec-9-enoate

Drug info:

PubChemData

Smile

C/C=C/CCCCCCCC(=O)OC

DOS

IR

Vibrations