Geometry & MOs

Info

ID:	332327
PubChem CID:	127250613
Reduced:	O2N5C24H27 (1)
Stoich.:	A2B5C24D27 (1)
Weight, g/mol:	417.216475
ΔH_f, kcal/mol:	8.39
Dipole, Da:	5.33
IP(EA), eV:	-8.65(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=N1)CN2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N

DOS

IR

Vibrations