Geometry & MOs

Info

ID:	282038
PubChem CID:	103914699
Reduced:	ClFNC13H17 (1)
Stoich.:	ABCD13E17 (1)
Weight, g/mol:	273.12957
ΔH_f, kcal/mol:	-42.13
Dipole, Da:	5.02
IP(EA), eV:	-9.1(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(4-chloro-3-fluorophenyl)ethylamino]hexan-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations