Geometry & MOs

Info

ID:	79406
PubChem CID:	49748481
Reduced:	FSN2O4H25C26 (1)
Stoich.:	ABC2D4E25F26 (1)
Weight, g/mol:	482.058184
ΔH_f, kcal/mol:	-125.19
Dipole, Da:	6.27
IP(EA), eV:	-8.26(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-difluoro-N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2(CC2)C(=O)NC3=CC4=C(CCCN4S(=O)(=O)C5=CC=C(C=C5)F)C=C3

DOS

IR

Vibrations