Geometry & MOs

Info

ID:	79405
PubChem CID:	49748479
Reduced:	FN2S2O3H21C23 (1)
Stoich.:	AB2C2D3E21F23 (1)
Weight, g/mol:	480.151907
ΔH_f, kcal/mol:	-82.54
Dipole, Da:	5.35
IP(EA), eV:	-8.41(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-1-(2-methoxyphenyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2)NC(=O)C3(CC3)C4=CC=CS4)N(C1)S(=O)(=O)C5=CC=C(C=C5)F

DOS

IR

Vibrations