Geometry & MOs

Info

ID:	279966
PubChem CID:	103845989
Reduced:	ClNF2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	294.96247
ΔH_f, kcal/mol:	-84.65
Dipole, Da:	3.61
IP(EA), eV:	-9.38(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-iodophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1Cl)F)F)NC

DOS

IR

Vibrations