Geometry & MOs

Info

ID:	8094
PubChem CID:	74950
Reduced:	SN2O2F3H7C13 (1)
Stoich.:	AB2C2D3E7F13 (1)
Weight, g/mol:	312.018033
ΔH_f, kcal/mol:	-93.32
Dipole, Da:	3.93
IP(EA), eV:	-8.6(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-8-(trifluoromethyl)phenothiazin-3-imine oxide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C(F)(F)F)N=C3C=CC(=[N+](O)[O-])C=C3S2

DOS

IR

Vibrations