Geometry & MOs

Info

ID:	13268
PubChem CID:	224689
Reduced:	SN3O8C24H35 (1)
Stoich.:	AB3C8D24E35 (1)
Weight, g/mol:	525.214486
ΔH_f, kcal/mol:	-323.23
Dipole, Da:	4.56
IP(EA), eV:	-8.03(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(diethylamino)ethylsulfanyl]ethyl]-6-methoxyquinolin-8-amine;2-hydroxypropane-1,2,3-tricarboxylic acid

Drug info:

PubChemData

Smile

CCN(CC)CCSCCNC1=C2C(=CC(=C1)OC)C=CC=N2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

DOS

IR

Vibrations