Geometry & MOs

Info

ID:	285502
PubChem CID:	104109928
Reduced:	ClNC13H20 (1)
Stoich.:	ABC13D20 (1)
Weight, g/mol:	245.073805
ΔH_f, kcal/mol:	-19.12
Dipole, Da:	3.57
IP(EA), eV:	-9.12(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2-chlorophenyl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CNC(C)CC(C)Cl

DOS

IR

Vibrations