Geometry & MOs

Info

ID:	88850
PubChem CID:	49957301
Reduced:	SN2O3H24C25 (1)
Stoich.:	AB2C3D24E25 (1)
Weight, g/mol:	296.108026
ΔH_f, kcal/mol:	-34.54
Dipole, Da:	10.47
IP(EA), eV:	-8.44(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-chloro-6-methyl-4-pyridin-3-yl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)NC5=CC=CC=C5

DOS

IR

Vibrations