Geometry & MOs

Info

ID:	408175
PubChem CID:	135080935
Reduced:	NSO4C6H9 (1)
Stoich.:	ABC4D6E9 (1)
Weight, g/mol:	187.084458
ΔH_f, kcal/mol:	-172.72
Dipole, Da:	4.29
IP(EA), eV:	-8.6(0.19)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-amino-3-butylbutanedioate

Drug info:

PubChemData

Smile

CCSC(C(C(=O)[O-])N)C(=O)[O-]

DOS

IR

Vibrations