Geometry & MOs

Info

ID:	420030
PubChem CID:	135110820
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	330.157957
ΔH_f, kcal/mol:	-42.53
Dipole, Da:	3.75
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-2-[[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]methyl]pyran-4-one

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=C(ON=C1N2CCCC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations