Geometry & MOs

Info

ID:	249240
PubChem CID:	103087987
Reduced:	FSCl2N2O2H5C6 (1)
Stoich.:	ABC2D2E2F5G6 (1)
Weight, g/mol:	246.11907
ΔH_f, kcal/mol:	-88.94
Dipole, Da:	3.66
IP(EA), eV:	-9.81(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylsulfanylbutyl)quinolin-6-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1S(=O)(=O)NN)Cl)F)Cl

DOS

IR

Vibrations