Geometry & MOs

Info

ID:	409008
PubChem CID:	135081781
Reduced:	N2O2C11H20 (1)
Stoich.:	A2B2C11D20 (1)
Weight, g/mol:	273.907306
ΔH_f, kcal/mol:	-64.8
Dipole, Da:	1.88
IP(EA), eV:	-7.83(1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z,3Z)-1,3-bis(dithiol-3-ylidene)propane-2-thione

Drug info:

PubChemData

Smile

COC[C@@H]1CCCN1NC2=CCCCO2

DOS

IR

Vibrations