Geometry & MOs

Info

ID:	339819
PubChem CID:	127261828
Reduced:	NOC3H4 (4)
Stoich.:	ABC3D4 (4)
Weight, g/mol:	175.095691
ΔH_f, kcal/mol:	-74.62
Dipole, Da:	6.68
IP(EA), eV:	-9.77(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]-N-hydroxypropanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations