Geometry & MOs

Info

ID:	57621
PubChem CID:	22426370
Reduced:	SCl2O3N4H20C23 (1)
Stoich.:	AB2C3D4E20F23 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-12.83
Dipole, Da:	5.64
IP(EA), eV:	-9.0(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxyphenyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C2N=C(NN2C1C3=CC=C(C=C3)Cl)SCC(=O)C4=CC=C(C=C4)Cl)C

DOS

IR

Vibrations