Geometry & MOs

Info

ID:	329839
PubChem CID:	127246706
Reduced:	ON6C18H20 (1)
Stoich.:	AB6C18D20 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	66.36
Dipole, Da:	3.46
IP(EA), eV:	-8.66(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenoxy)-1-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C(=O)CN3C4=CC=CC=C4N=N3

DOS

IR

Vibrations