Geometry & MOs

Info

ID:	88863
PubChem CID:	49957333
Reduced:	FN2O2H17C19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	430.171499
ΔH_f, kcal/mol:	0.8
Dipole, Da:	5.36
IP(EA), eV:	-8.81(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2C(=C(C=C1)[N+](=O)[O-])C3C=CCC3C(N2)C4=CC=C(C=C4)F

DOS

IR

Vibrations