Geometry & MOs

Info

ID:	448702
PubChem CID:	135292865
Reduced:	N4O15C26H32 (1)
Stoich.:	A4B15C26D32 (1)
Weight, g/mol:	280.082347
ΔH_f, kcal/mol:	-609.13
Dipole, Da:	2.79
IP(EA), eV:	-9.2(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-4-(trifluoromethyl)-8,9-dihydro-1H-pyrido[3,2-g]quinolin-2-one

Drug info:

PubChemData

Smile

CNC(=O)C(C(C(C=O)(O)O)(O)O)(N1C(=O)C2=C(C1(O)O)C(=CC=C2)NC(C3=CC=C(C=C3)C(N4CCOCC4)(O)O)(O)O)O

DOS

IR

Vibrations