Geometry & MOs

Info

ID:	407992
PubChem CID:	135080747
Reduced:	PSC6O8H13 (1)
Stoich.:	ABC6D8E13 (1)
Weight, g/mol:	185.068808
ΔH_f, kcal/mol:	-419.03
Dipole, Da:	3.6
IP(EA), eV:	-9.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-(cyclopropylamino)-3-methylbutanedioate

Drug info:

PubChemData

Smile

C([C@@H](C(C(C(=O)CSP(=O)(O)O)O)O)O)O

DOS

IR

Vibrations