Geometry & MOs

Info

ID:	66485
PubChem CID:	46504662
Reduced:	ClFON3C23H23 (1)
Stoich.:	ABCD3E23F23 (1)
Weight, g/mol:	349.179027
ΔH_f, kcal/mol:	-47.6
Dipole, Da:	2.06
IP(EA), eV:	-7.98(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)F)Cl)C(=C2)C

DOS

IR

Vibrations