Geometry & MOs

Info

ID:	258409
PubChem CID:	103153477
Reduced:	NSO5C8H15 (1)
Stoich.:	ABC5D8E15 (1)
Weight, g/mol:	340.989149
ΔH_f, kcal/mol:	-200.27
Dipole, Da:	3.88
IP(EA), eV:	-9.9(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2,6-dichlorophenyl)sulfonylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNS(=O)(=O)C1CC1

DOS

IR

Vibrations