Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline-κN1,κN10)-, (OC-6-11)-, sulfate (1:1)

CAS Registry Number®

14639-04-4
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CAS Name

Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline-κN1,κN10)-, (OC-6-11)-, sulfate (1:1)

Molecular Formula

C48H48FeN6.O4S

Cite this Page

Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline-κN1,κN10)-, (OC-6-11)-, sulfate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14639-04-4 (retrieved 2024-09-07) (CAS RN: 14639-04-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/3C16H16N2.Fe.H2O4S/c3*1-9-7-17-15-13(11(9)3)5-6-14-12(4)10(2)8-18-16(14)15;;1-5(2,3)4/h3*5-8H,1-4H3;;(H2,1,2,3,4)/q;;;+2;/p-2

InChIKey

InChIKey=PLYRLSMTBJYNRX-UHFFFAOYSA-L

SMILES

CC=1C=[N]2[Fe+2]34([N]=5C=6C=7[N]3=CC(C)=C(C)C7C=CC6C(C)=C(C)C5)([N]=8C=9C=%10[N]4=CC(C)=C(C)C%10C=CC9C(C)=C(C)C8)[N]=%11C=%12C2=C(C1C)C=CC%12C(C)=C(C)C%11.S(=O)(=O)([O-])[O-]

Canonical SMILES

O=S(=O)([O-])[O-].C=1C=C2C3=C4C1C(=C(C=[N]4[Fe+2]56([N]3=CC(=C2C)C)([N]7=CC(=C(C8=CC=C9C(=C87)[N]5=CC(=C9C)C)C)C)[N]%10=CC(=C(C%11=CC=C%12C(=C%11%10)[N]6=CC(=C%12C)C)C)C)C)C

Other Names for this Substance

  • Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline-κN1,κN10)-, (OC-6-11)-, sulfate (1:1)
  • Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline-N1,N10)-, (OC-6-11)-, sulfate (1:1)
  • Iron(2+), tris(3,4,7,8-tetramethyl-1,10-phenanthroline)-, sulfate (1:1)
  • Tris(3,4,7,8-tetramethyl-1,10-phenanthroline)iron sulfate
  • 1,10-Phenanthroline, 3,4,7,8-tetramethyl-, iron complex

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