Geometry & MOs

Info

ID:	287426
PubChem CID:	104242055
Reduced:	ClNC16H18 (1)
Stoich.:	ABC16D18 (1)
Weight, g/mol:	334.96161
ΔH_f, kcal/mol:	8.69
Dipole, Da:	0.8
IP(EA), eV:	-9.08(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,6,8-tetrachloro-2-cyclopentylquinoline

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1)N=C(C=C2Cl)C3CCCC3

DOS

IR

Vibrations