Geometry & MOs

Info

ID:

50189

PubChem CID:

12012700

Reduced:

SN2O3H15C18 (1)

Stoich.:

AB2C3D15E18 (1)

Weight, g/mol:

320.912225

ΔHf, kcal/mol:

44.89

Dipole, Da:

8.71

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.969202

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CSC(=C1)C(=O)C[N+]2=CC=C(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations