Geometry & MOs

Info

ID:	338200
PubChem CID:	127258892
Reduced:	FNCl2O3C8H10 (1)
Stoich.:	ABC2D3E8F10 (1)
Weight, g/mol:	169.065827
ΔH_f, kcal/mol:	-221.41
Dipole, Da:	2.87
IP(EA), eV:	-9.78(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-phenylprop-2-en-1-amine;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C(C(=O)O)N)O.Cl.Cl

DOS

IR

Vibrations