Geometry & MOs

Info

ID:	361880
PubChem CID:	127304874
Reduced:	N3O3C20H33 (1)
Stoich.:	A3B3C20D33 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	-157.71
Dipole, Da:	5.33
IP(EA), eV:	-8.83(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[2-(morpholin-4-ylmethyl)piperidin-1-yl]-3-oxopropyl]cinnolin-4-one

Drug info:

PubChemData

Smile

C1CCC(C1)N2CC(CC2=O)C(=O)N3CCCCC3CN4CCOCC4

DOS

IR

Vibrations