Geometry & MOs

Info

ID:	261036
PubChem CID:	103215315
Reduced:	ClIN3C13H15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	392.95928
ΔH_f, kcal/mol:	57.85
Dipole, Da:	5.31
IP(EA), eV:	-9.23(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-iodophenyl)-1-(2,6-difluorophenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CCCN1C=CN=C1C(C2=CC(=C(C=C2)I)Cl)N

DOS

IR

Vibrations