Geometry & MOs

Info

ID:	340898
PubChem CID:	127263333
Reduced:	ClFNOC11H15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	221.017433
ΔH_f, kcal/mol:	-88.65
Dipole, Da:	3.9
IP(EA), eV:	-9.07(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-2-(4-chloro-3-fluorophenyl)cyclopropan-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)[C@H]2C[C@@H]2N)F.Cl

DOS

IR

Vibrations