Geometry & MOs

Info

ID:	177337
PubChem CID:	76169173
Reduced:	SO3N4C15H18 (1)
Stoich.:	AB3C4D15E18 (1)
Weight, g/mol:	325.167794
ΔH_f, kcal/mol:	-75.14
Dipole, Da:	5.22
IP(EA), eV:	-9.94(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-7,7-dimethyl-3-(2,4,6-trimethylphenyl)-6,8-dihydro-4aH-quinoline-2,5-dione

Drug info:

PubChemData

Smile

CCCC1=NN=C(S1)NC(=O)C2=C(C3CCCCC3=NC2=O)O

DOS

IR

Vibrations