Geometry & MOs

Info

ID:	88770
PubChem CID:	49956663
Reduced:	ClNO2H18C20 (1)
Stoich.:	ABC2D18E20 (1)
Weight, g/mol:	384.97726
ΔH_f, kcal/mol:	-36.23
Dipole, Da:	3.62
IP(EA), eV:	-8.69(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8,9-trichloro-4-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations