Geometry & MOs

Info

ID:	271850
PubChem CID:	103694331
Reduced:	FNOSC16H18 (1)
Stoich.:	ABCDE16F18 (1)
Weight, g/mol:	324.89631
ΔH_f, kcal/mol:	-38.01
Dipole, Da:	3.07
IP(EA), eV:	-8.62(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-2-iodophenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CCNCC1=C(C=CC=C1F)OC2=CC=C(C=C2)SC

DOS

IR

Vibrations