Geometry & MOs

Info

ID:	293558
PubChem CID:	117392998
Reduced:	ClFNC14H19 (1)
Stoich.:	ABCD14E19 (1)
Weight, g/mol:	255.119005
ΔH_f, kcal/mol:	-64.22
Dipole, Da:	2.04
IP(EA), eV:	-9.25(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-chloro-4-(1-fluoroethyl)phenyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)Cl)F)CC2CCCN2

DOS

IR

Vibrations