Geometry & MOs

Info

ID:	88854
PubChem CID:	49957310
Reduced:	FSN2O2H25C26 (1)
Stoich.:	ABC2D2E25F26 (1)
Weight, g/mol:	420.130777
ΔH_f, kcal/mol:	-58.65
Dipole, Da:	6.44
IP(EA), eV:	-8.3(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-N-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=CC=C(C=C5)F)C

DOS

IR

Vibrations