Geometry & MOs

Info

ID:	331998
PubChem CID:	127250284
Reduced:	O3N4H20C21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	388.153541
ΔH_f, kcal/mol:	-11.53
Dipole, Da:	4.66
IP(EA), eV:	-9.23(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-(pyridine-2-carbonyl)morpholin-2-yl]pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)COC2=CC=CC=C2)C3=NC=C(C=C3)C4=CN=CN=C4

DOS

IR

Vibrations