Geometry & MOs

Info

ID:

401768

PubChem CID:

135052478

Reduced:

NS2H14C16 (1)

Stoich.:

AB2C14D16 (1)

Weight, g/mol:

198.999861

ΔHf, kcal/mol:

76.22

Dipole, Da:

4.31

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.058017

Charge, e:

 0

Chem-info

IUPAC name:

1,3-thiazole-2-diazonium;tetrafluoroborate

Drug info:

PubChemData

Smile

CC1=C(SC(=[N+]1C2=CC=CC=C2)C3=CC=CC=C3)S

DOS

IR

Vibrations