Geometry & MOs

Info

ID:	401523
PubChem CID:	135051510
Reduced:	S4H5C7 (1)
Stoich.:	A4B5C7 (1)
Weight, g/mol:	217.935235
ΔH_f, kcal/mol:	97.73
Dipole, Da:	0.34
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.770124
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(5Z)-5-(2-sulfanylideneethylidene)dithiolan-3-ylidene]ethanethial

Drug info:

PubChemData

Smile

[CH+]\1/C(=C/C=S)/SS/C1=C\C=S

DOS

IR

Vibrations