Geometry & MOs

Info

ID:	325670
PubChem CID:	126684416
Reduced:	SF2O7C17H30 (1)
Stoich.:	AB2C7D17E30 (1)
Weight, g/mol:	352.155574
ΔH_f, kcal/mol:	-443.38
Dipole, Da:	4.54
IP(EA), eV:	-10.53(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-tert-butyl-4,4-dimethylpentanoyl)oxyethoxy]-2-oxoethanesulfonic acid

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C(=O)OCCCOC(=O)C(F)(F)S(=O)(=O)O)C(C)(C)C

DOS

IR

Vibrations