Geometry & MOs

Info

ID:	290552
PubChem CID:	104644031
Reduced:	NSO5C7H15 (1)
Stoich.:	ABC5D7E15 (1)
Weight, g/mol:	239.082744
ΔH_f, kcal/mol:	-227.85
Dipole, Da:	3.71
IP(EA), eV:	-10.16(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-2-methyl-3-(2-methylsulfonylethylamino)propanoate

Drug info:

PubChemData

Smile

CC(CNCCS(=O)(=O)C)(C(=O)O)O

DOS

IR

Vibrations