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Substance Name: Iron(3+), tris(octamethyl pyrophosphoramide)-, tris(tetrachloroiron(1-))
RN: 15713-63-0
InChIKey: XIWCAOKQGRQGLR-UHFFFAOYSA-B

Molecular Formula

  • C24-H72-N12-O9-P6.Fe.Cl12-Fe3

Molecular Weight

  • 1507.57
 
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Names and Synonyms

Synonym

  • Tris(octamethyl pyrophosphoramide)iron(3+) tris(tetrachloroiron(1-))

Systematic Name

  • Iron(3+), tris(octamethyl pyrophosphoramide)-, tris(tetrachloroiron(1-))

Registry Numbers

CAS Registry Number

  • 15713-63-0

System Generated Number

  • 0015713630

Molecular Formulas

Molecular Formula

  • C24-H72-N12-O9-P6.Fe.Cl12-Fe3

Molecular Formula Fragments

  • C24-H72-N12-O9-P6
  • Cl12-Fe3
  • COMPONENT
  • Fe

Structure Descriptors

InChI

1S/3C8H24N4O3P2.12ClH.4Fe/c3*1-9(2)16(13,10(3)4)15-17(14,11(5)6)12(7)8;;;;;;;;;;;;;;;;/h3*1-8H3;12*1H;;;;/q;;;;;;;;;;;;;;;4*+3/p-12

InChIKey

XIWCAOKQGRQGLR-UHFFFAOYSA-B

Smiles

P(OP(N(C)C)(N(C)C)=O)(N(C)C)(N(C)C)=O.P(OP(N(C)C)(N(C)C)=O)(N(C)C)(N(C)C)=O.P(OP(N(C)C)(N(C)C)=O)(N(C)C)(N(C)C)=O.[Fe-](Cl)(Cl)(Cl)Cl.[Fe-](Cl)(Cl)(Cl)Cl.[Fe-](Cl)(Cl)(Cl)Cl.[Fe+3]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 4800ug/kg (4.8mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 14, Pg. 512, 1966.