Geometry & MOs

Info

ID:	122217
PubChem CID:	50798144
Reduced:	FON5C28H28 (1)
Stoich.:	ABC5D28E28 (1)
Weight, g/mol:	464.257612
ΔH_f, kcal/mol:	23.92
Dipole, Da:	3.68
IP(EA), eV:	-8.5(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-benzylpiperidin-1-yl)propyl]-2-pyridin-2-ylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4)C5=CC=C(C=C5)F

DOS

IR

Vibrations