Geometry & MOs

Info

ID:	212937
PubChem CID:	81062337
Reduced:	N2S2O5C11H18 (1)
Stoich.:	A2B2C5D11E18 (1)
Weight, g/mol:	189.100108
ΔH_f, kcal/mol:	-175.32
Dipole, Da:	3.41
IP(EA), eV:	-9.9(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(2-propan-2-yloxyethyl)amino]-2-oxoacetic acid

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N

DOS

IR

Vibrations