Geometry & MOs

Info

ID:	331991
PubChem CID:	127250277
Reduced:	ON4C20H22 (1)
Stoich.:	AB4C20D22 (1)
Weight, g/mol:	422.231791
ΔH_f, kcal/mol:	51.63
Dipole, Da:	2.45
IP(EA), eV:	-8.94(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]morpholin-2-yl]pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1CCC2=CC=CC=C2)C3=NC=C(C=C3)C4=CC=NN4

DOS

IR

Vibrations