Geometry & MOs

Info

ID:	8203
PubChem CID:	75314
Reduced:	N2O5C12H14 (1)
Stoich.:	A2B5C12D14 (1)
Weight, g/mol:	266.090272
ΔH_f, kcal/mol:	-199.3
Dipole, Da:	2.25
IP(EA), eV:	-9.86(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)N)C(=O)O

DOS

IR

Vibrations