Geometry & MOs

Info

ID:	332945
PubChem CID:	127251369
Reduced:	O3N6C24H28 (1)
Stoich.:	A3B6C24D28 (1)
Weight, g/mol:	411.190654
ΔH_f, kcal/mol:	-47.19
Dipole, Da:	5.0
IP(EA), eV:	-9.11(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[4-(2-acetamidoacetyl)morpholin-2-yl]-6-methylpyridin-4-yl]-N-methylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CCN3C=CN=C3C)C4=CN=C(C=C4)C(=O)NC

DOS

IR

Vibrations