Geometry & MOs

Info

ID:	151199
PubChem CID:	53790899
Reduced:	N2O7C27H56 (1)
Stoich.:	A2B7C27D56 (1)
Weight, g/mol:	325.855288
ΔH_f, kcal/mol:	-397.27
Dipole, Da:	0.79
IP(EA), eV:	-9.06(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl) (2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)sulfanylmethanethioate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCOCCCNCCCNC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O

DOS

IR

Vibrations