Geometry & MOs

Info

ID:	347488
PubChem CID:	127272343
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	396.179755
ΔH_f, kcal/mol:	-73.72
Dipole, Da:	5.66
IP(EA), eV:	-8.85(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-(4-morpholin-4-ylbenzoyl)piperazine-1-carbonyl]-1H-pyridin-2-one

Drug info:

PubChemData

Smile

C1COCC1CN2C(=CC=N2)NC(=O)C3C4CC5CC(C4)CC3C5

DOS

IR

Vibrations