Geometry & MOs

Info

ID:	388614
PubChem CID:	134989662
Reduced:	OSN4H8C12 (1)
Stoich.:	ABC4D8E12 (1)
Weight, g/mol:	171.057668
ΔH_f, kcal/mol:	111.53
Dipole, Da:	7.97
IP(EA), eV:	-9.03(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-chloro-2,3,5,6-tetramethylpyrylium

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C(=O)N3C(=S)N=NN3

DOS

IR

Vibrations