Geometry & MOs

Info

ID:	326298
PubChem CID:	126687295
Reduced:	ClFON7H15C16 (1)
Stoich.:	ABCD7E15F16 (1)
Weight, g/mol:	134.121927
ΔH_f, kcal/mol:	-7.18
Dipole, Da:	3.31
IP(EA), eV:	-9.17(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,4R)-3-fluorohexane-2,4-diamine

Drug info:

PubChemData

Smile

C1C[C@@](NC1=O)(CNC2=NC(=NC=C2F)C3=CNC4=C3C=C(C=N4)Cl)N

DOS

IR

Vibrations