Geometry & MOs

Info

ID:	346187
PubChem CID:	127270678
Reduced:	SN4O4C16H22 (1)
Stoich.:	AB4C4D16E22 (1)
Weight, g/mol:	290.143056
ΔH_f, kcal/mol:	-137.72
Dipole, Da:	6.44
IP(EA), eV:	-9.0(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(3-methylpyrrolidin-1-yl)ethane-1,2-dione

Drug info:

PubChemData

Smile

CN(CC(=O)N1CCOCC1)C(=O)CC2=CSC(=N2)N3CCCC3=O

DOS

IR

Vibrations