Geometry & MOs

Info

ID:	10752
PubChem CID:	107573
Reduced:	N2O5C14H18 (1)
Stoich.:	A2B5C14D18 (1)
Weight, g/mol:	294.121572
ΔH_f, kcal/mol:	-202.91
Dipole, Da:	4.86
IP(EA), eV:	-9.68(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](CC(=O)N)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations