Geometry & MOs

Info

ID:	430805
PubChem CID:	135170872
Reduced:	ON3C26H31 (1)
Stoich.:	AB3C26D31 (1)
Weight, g/mol:	418.189257
ΔH_f, kcal/mol:	4.45
Dipole, Da:	1.8
IP(EA), eV:	-8.5(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxyoxolan-2-yl)-[4-(4-quinolin-3-ylphenoxy)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCN(C1CCCC(C1)N2CCC3=CC=CC=C3C2)C(=O)C4=CC5=CC=CC=C5N4

DOS

IR

Vibrations