Geometry & MOs

Info

ID:	361166
PubChem CID:	127302110
Reduced:	N2O3C22H28 (1)
Stoich.:	A2B3C22D28 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-108.54
Dipole, Da:	3.52
IP(EA), eV:	-8.5(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2(CCOCC2)CNC(=O)C3=CC4=CC=CC=C4C=C3O

DOS

IR

Vibrations