Geometry & MOs

Info

ID:	148907
PubChem CID:	53788577
Reduced:	I3N3O8C20H28 (1)
Stoich.:	A3B3C8D20E28 (1)
Weight, g/mol:	177.078979
ΔH_f, kcal/mol:	-293.58
Dipole, Da:	6.89
IP(EA), eV:	-9.93(-2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-6-methyl-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC(=O)N(CCCC(CO)O)C1=C(C(=C(C(=C1I)C(=O)NC(CO)CO)I)C(=O)NCCO)I

DOS

IR

Vibrations