Geometry & MOs

Info

ID:	377875
PubChem CID:	134223940
Reduced:	O2F3N4H17C22 (1)
Stoich.:	A2B3C4D17E22 (1)
Weight, g/mol:	195.017642
ΔH_f, kcal/mol:	-135.79
Dipole, Da:	5.25
IP(EA), eV:	-9.07(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(disulfanyl)-7,8-dihydroquinoline

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=CC(=C1)C2=NC=CC3=C2OC(=C3NC4=CC=C(C=C4)C(F)(F)F)N

DOS

IR

Vibrations