Geometry & MOs

Info

ID:	247044
PubChem CID:	103066838
Reduced:	NOCl2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	331.04331
ΔH_f, kcal/mol:	-29.79
Dipole, Da:	4.71
IP(EA), eV:	-8.97(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-iodophenoxy)methyl]-N-propan-2-ylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)NCC(=C)COC1=C(C(=CC=C1)Cl)Cl

DOS

IR

Vibrations