Geometry & MOs

Info

ID:	335647
PubChem CID:	127254509
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	333.086189
ΔH_f, kcal/mol:	-110.48
Dipole, Da:	3.37
IP(EA), eV:	-8.82(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-oxo-N-(4-oxo-1H-1,2,3-benzotriazin-6-yl)-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C(=O)CCCC(=O)N2CCN(CC2)CC3=CC=CC=C3

DOS

IR

Vibrations