Geometry & MOs

Info

ID:	10245
PubChem CID:	99356
Reduced:	SN3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	267.083019
ΔH_f, kcal/mol:	86.26
Dipole, Da:	1.4
IP(EA), eV:	-8.53(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzylamino)quinoxaline-2-thiol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3N=C2S

DOS

IR

Vibrations