Geometry & MOs

Info

ID:	29477
PubChem CID:	834083
Reduced:	ClNC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	243.058155
ΔH_f, kcal/mol:	0.22
Dipole, Da:	3.02
IP(EA), eV:	-9.13(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dichlorophenyl)methyl]cyclopentanamine

Drug info:

PubChemData

Smile

C1CCC(C1)NCC2=CC=C(C=C2)Cl

DOS

IR

Vibrations