Geometry & MOs

Info

ID:	332192
PubChem CID:	127250478
Reduced:	O3N5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	402.169191
ΔH_f, kcal/mol:	-33.59
Dipole, Da:	3.14
IP(EA), eV:	-8.76(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-[4-(2-pyridin-2-ylacetyl)morpholin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCC(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CN=C(N=C4)N

DOS

IR

Vibrations