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Meso-5,10,15,20-tetrakis(pentafluorophenyl)porphyrinatoplatinum

Catalog Number ACM109781477-2
CAS 109781-47-7
Structure Meso-5,10,15,20-tetrakis(pentafluorophenyl)porphyrinatoplatinum
Synonyms Platinum(II) meso-tetra(pentafluorophenyl)porphine
Molecular Weight 1167.62
Molecular Formula C44H8F20N4Pt
Canonical SMILES C1=CC2=C(C3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C1[N-]2)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C8=C(C(=C(C(=C8F)F)F)F)F)C=C3)C9=C(C(=C(C(=C9F)F)F)F)F.[Pt+2]
InChI InChI=1S/C44H8F20N4.Pt/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50;/h1-8H;/q-2;+2
InChI Key OXKPMKLTIJUTAM-UHFFFAOYSA-N
Purity 98%
Complexity 1960
Covalently-Bonded Unit Count 2
Defined Atom Stereocenter Count 0
Exact Mass 1167.007754
Heavy Atom Count 69
Hydrogen Bond Acceptor Count 24
Hydrogen Bond Donor Count 0
Monoisotopic Mass 1167.007754
Rotatable Bond Count 4
Topological Polar Surface Area 26.7 Ų

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