Geometry & MOs

Info

ID:	337797
PubChem CID:	127258420
Reduced:	SO7C18H34 (1)
Stoich.:	AB7C18D34 (1)
Weight, g/mol:	506.43351
ΔH_f, kcal/mol:	-369.99
Dipole, Da:	5.13
IP(EA), eV:	-10.96(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yloxy)-2-oxoethyl]icosanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCC(COC(=O)CCC(=O)OCC)S(=O)(=O)O

DOS

IR

Vibrations