Geometry & MOs

Info

ID:	388660
PubChem CID:	134989777
Reduced:	FeP4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	193.01975
ΔH_f, kcal/mol:	-58.33
Dipole, Da:	7.12
IP(EA), eV:	-6.93(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methylphenyl)-1,3,2-oxathiazol-1-ium-5-olate

Drug info:

PubChemData

Smile

C[C]1[C]([P][CH][P]1)C.C[C]1[C]([P][CH][P]1)C.[Fe]

DOS

IR

Vibrations