Geometry & MOs

Info

ID:	332115
PubChem CID:	127250401
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	417.205242
ΔH_f, kcal/mol:	-67.79
Dipole, Da:	2.14
IP(EA), eV:	-8.51(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCOC(C1)C2=NC=C(C=C2)C3=CN=CN=C3)OC4=CC=C(C=C4)OC

DOS

IR

Vibrations