Geometry & MOs

Info

ID:	79298
PubChem CID:	49747907
Reduced:	SF2N2O3C14H16 (1)
Stoich.:	AB2C2D3E14F16 (1)
Weight, g/mol:	502.134462
ΔH_f, kcal/mol:	-147.68
Dipole, Da:	3.99
IP(EA), eV:	-9.22(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N'-(1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)oxamide

Drug info:

PubChemData

Smile

CN(C)C(CNS(=O)(=O)C1=CC(=CC(=C1)F)F)C2=CC=CO2

DOS

IR

Vibrations