Geometry & MOs

Info

ID:	88861
PubChem CID:	49957318
Reduced:	Cl2N2H14C17 (1)
Stoich.:	A2B2C14D17 (1)
Weight, g/mol:	498.093555
ΔH_f, kcal/mol:	52.25
Dipole, Da:	4.35
IP(EA), eV:	-8.59(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,6-dichlorophenyl)-N-(3,5-dimethylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide

Drug info:

PubChemData

Smile

C1C=CC2C1C(NC3=C2C=C(C=C3Cl)Cl)C4=CN=CC=C4

DOS

IR

Vibrations