Geometry & MOs

Info

ID:

47705

PubChem CID:

10534869

Reduced:

NO2C8H11 (1)

Stoich.:

AB2C8D11 (1)

Weight, g/mol:

153.036068

ΔHf, kcal/mol:

-58.78

Dipole, Da:

3.21

IP(EA), eV:

-10.8(-0.36)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCCCC#N

DOS

IR

Vibrations