Geometry & MOs

Info

ID:	401438
PubChem CID:	135051273
Reduced:	Cl2S2H14C23 (1)
Stoich.:	A2B2C14D23 (1)
Weight, g/mol:	314.883839
ΔH_f, kcal/mol:	88.54
Dipole, Da:	5.75
IP(EA), eV:	-8.45(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

3-chloro-N-(3-chlorodithiol-1-ium-4-yl)-N-ethyldithiol-1-ium-4-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=S(S2)Cl)C3=C4C=CC=CC4=C(C5=CC=CC=C53)Cl

DOS

IR

Vibrations