Geometry & MOs

Info

ID:	369130
PubChem CID:	127331362
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	358.164105
ΔH_f, kcal/mol:	-43.16
Dipole, Da:	6.57
IP(EA), eV:	-8.96(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=O)C(=N1)C(=O)N3CC4CC5CC(C4)CC3C5

DOS

IR

Vibrations