Geometry & MOs

Info

ID:	348400
PubChem CID:	127273493
Reduced:	FON4C21H21 (1)
Stoich.:	ABC4D21E21 (1)
Weight, g/mol:	382.180504
ΔH_f, kcal/mol:	-24.22
Dipole, Da:	2.3
IP(EA), eV:	-8.52(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC=C(C=C2)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)F

DOS

IR

Vibrations