Geometry & MOs

Info

ID:	1057
PubChem CID:	3729
Reduced:	INC12H18 (1)
Stoich.:	ABC12D18 (1)
Weight, g/mol:	303.0484
ΔH_f, kcal/mol:	11.7
Dipole, Da:	2.42
IP(EA), eV:	-8.86(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-N-propan-2-ylpropan-2-amine

Drug info:

PubChemData

Smile

CC(C)NC(C)CC1=CC=C(C=C1)I

DOS

IR

Vibrations