Geometry & MOs

Info

ID:	289986
PubChem CID:	104394942
Reduced:	ClNC6H9 (2)
Stoich.:	ABC6D9 (2)
Weight, g/mol:	246.069054
ΔH_f, kcal/mol:	-4.38
Dipole, Da:	1.22
IP(EA), eV:	-8.75(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(2,4-dichlorophenyl)methyl]-1-N-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CNC)NCCC1=CC(=C(C=C1)Cl)Cl

DOS

IR

Vibrations