Geometry & MOs

Info

ID:	261027
PubChem CID:	103214896
Reduced:	NOF3C11H22 (1)
Stoich.:	ABC3D11E22 (1)
Weight, g/mol:	436.96103
ΔH_f, kcal/mol:	-236.91
Dipole, Da:	2.86
IP(EA), eV:	-8.98(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-4-fluorophenyl)-1-(3-chloro-4-iodophenyl)-N-ethylethanamine

Drug info:

PubChemData

Smile

CCNC(CCC(C)C)COCC(F)(F)F

DOS

IR

Vibrations