Geometry & MOs

Info

ID:	203978
PubChem CID:	79896062
Reduced:	SN3O3C12H21 (1)
Stoich.:	AB3C3D12E21 (1)
Weight, g/mol:	199.120843
ΔH_f, kcal/mol:	-129.43
Dipole, Da:	6.69
IP(EA), eV:	-8.18(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[cyclopentyl(2-hydroxyethyl)amino]prop-2-enoic acid

Drug info:

PubChemData

Smile

CCC(C)(CNC1=C(C(=CC(=C1)N)S(=O)(=O)N)C)O

DOS

IR

Vibrations