Geometry & MOs

Info

ID:	47741
PubChem CID:	10535019
Reduced:	OC5H6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	164.131349
ΔH_f, kcal/mol:	-27.91
Dipole, Da:	2.41
IP(EA), eV:	-9.6(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methylphenyl)propane-1,3-diamine

Drug info:

PubChemData

Smile

COC[C@]1(CO1)C2=CC=CC=C2

DOS

IR

Vibrations