Geometry & MOs

Info

ID:	341853
PubChem CID:	127264546
Reduced:	ClNO4C15H22 (1)
Stoich.:	ABC4D15E22 (1)
Weight, g/mol:	253.108086
ΔH_f, kcal/mol:	-216.66
Dipole, Da:	4.72
IP(EA), eV:	-9.48(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 5-O-methyl (2R)-2-aminopentanedioate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@H](CC(=O)OCC1=CC=CC=C1)N.Cl

DOS

IR

Vibrations