Geometry & MOs

Info

ID:	85631
PubChem CID:	49877799
Reduced:	ON4H14C16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	425.158685
ΔH_f, kcal/mol:	72.26
Dipole, Da:	9.24
IP(EA), eV:	-8.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-hydroxy-4-oxo-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)/C(=C\NNC(=O)C3=CC=C(C=C3)N)/C=N2

DOS

IR

Vibrations