Geometry & MOs

Info

ID:	261154
PubChem CID:	103220466
Reduced:	ON4C14H16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	422.94538
ΔH_f, kcal/mol:	41.68
Dipole, Da:	5.16
IP(EA), eV:	-9.54(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-fluoro-5-methylphenyl)-1-(3-chloro-4-iodophenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

C1CC(C1)NC2=CC(=O)N(N=C2)CC3=CC=NC=C3

DOS

IR

Vibrations