Geometry & MOs

Info

ID:	326153
PubChem CID:	126686773
Reduced:	ClFN5H9C12 (1)
Stoich.:	ABC5D9E12 (1)
Weight, g/mol:	203.152144
ΔH_f, kcal/mol:	38.43
Dipole, Da:	1.59
IP(EA), eV:	-8.83(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,3S,4S)-4-amino-3-hydroxy-2-methyloctanoate

Drug info:

PubChemData

Smile

CN1C=C(C2=C1N=CC(=C2)Cl)C3=NC=C(C(=N3)N)F

DOS

IR

Vibrations