Geometry & MOs

Info

ID:	402695
PubChem CID:	135056927
Reduced:	BrClON2C4H6 (1)
Stoich.:	ABCD2E4F6 (1)
Weight, g/mol:	175.056405
ΔH_f, kcal/mol:	-17.34
Dipole, Da:	3.87
IP(EA), eV:	-10.59(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-2-fluoro-1-phenylethyl]azanium;chloride

Drug info:

PubChemData

Smile

C1=C(ON=C1Br)C[NH3+].[Cl-]

DOS

IR

Vibrations