Geometry & MOs

Info

ID:	233382
PubChem CID:	89854680
Reduced:	ON2F3C10H11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	335.16925
ΔH_f, kcal/mol:	-166.93
Dipole, Da:	4.38
IP(EA), eV:	-8.51(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S)-3-amino-4-[2-[(2S)-2-aminopropanoyl]oxyethoxy]-4-oxobutan-2-yl] (2S,3R)-2-amino-3-hydroxybutanoate

Drug info:

PubChemData

Smile

C1C(CN1C2=C(C=C(C=C2)N)C(F)(F)F)O

DOS

IR

Vibrations