Geometry & MOs

Info

ID:	200464
PubChem CID:	79391360
Reduced:	SO2C8H16 (1)
Stoich.:	AB2C8D16 (1)
Weight, g/mol:	225.08235
ΔH_f, kcal/mol:	-122.2
Dipole, Da:	3.7
IP(EA), eV:	-8.84(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-aminophenyl)sulfanyl-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)SC(C)C(C)C(=O)O

DOS

IR

Vibrations