Geometry & MOs

Info

ID:	285524
PubChem CID:	104110017
Reduced:	ClNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	279.034833
ΔH_f, kcal/mol:	-52.34
Dipole, Da:	1.51
IP(EA), eV:	-8.75(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2,5-dichlorophenyl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCC1=CC=CC=C1OC

DOS

IR

Vibrations