Geometry & MOs

Info

ID:	24458
PubChem CID:	610382
Reduced:	ON2S2H4C8 (1)
Stoich.:	AB2C2D4E8 (1)
Weight, g/mol:	207.976505
ΔH_f, kcal/mol:	56.22
Dipole, Da:	1.44
IP(EA), eV:	-9.68(-2.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methyl-2-oxothieno[3,2-b]thiophen-5-ylidene)cyanamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC(=O)S2)SC1=NC#N

DOS

IR

Vibrations