Geometry & MOs

Info

ID:	261063
PubChem CID:	103215917
Reduced:	ClINOC16H21 (1)
Stoich.:	ABCDE16F21 (1)
Weight, g/mol:	370.99377
ΔH_f, kcal/mol:	-36.04
Dipole, Da:	2.03
IP(EA), eV:	-9.52(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-iodophenyl)-(3-ethylphenyl)methanamine

Drug info:

PubChemData

Smile

C1CCC2(C1)CC(CCO2)C(C3=CC(=C(C=C3)I)Cl)N

DOS

IR

Vibrations