Geometry & MOs

Info

ID:	388624
PubChem CID:	134989685
Reduced:	ClNS3H6C7 (1)
Stoich.:	ABC3D6E7 (1)
Weight, g/mol:	315.03812
ΔH_f, kcal/mol:	51.18
Dipole, Da:	2.54
IP(EA), eV:	-8.5(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(diethylamino)-3-(dimethylamino)-1lambda4,2-dithia-4-azacyclopenta-3,5-dien-1-yl] hydrogen sulfate

Drug info:

PubChemData

Smile

CSC1=CC2=C(C=C1)N=S(S2)Cl

DOS

IR

Vibrations