Geometry & MOs

Info

ID:	227823
PubChem CID:	87562590
Reduced:	SN2O5C19H36 (1)
Stoich.:	AB2C5D19E36 (1)
Weight, g/mol:	332.194737
ΔH_f, kcal/mol:	-296.43
Dipole, Da:	2.43
IP(EA), eV:	-8.86(0.25)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

2,2-bis[1-(2-hydroxyethyl)pyrrolidin-1-ium-1-yl]propanedioic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(CSC(C)(C)C)NC(=O)C(C(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations