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DICYANO-(MESO-PROPYL-TRICYClOPROPYLPORPHYRINATO)-IRON-(III);FE(T(C)PRP)(CN)2

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DICYANO-(MESO-PROPYL-TRICYClOPROPYLPORPHYRINATO)-IRON-(III);FE(T(C)PRP)(CN)2
SpectraBase Compound ID 8JtC03keuPM
InChI InChI=1S/C32H30N4.2CN.Fe/c1-2-3-21-22-10-12-24(33-22)30(18-4-5-18)26-14-16-28(35-26)32(20-8-9-20)29-17-15-27(36-29)31(19-6-7-19)25-13-11-23(21)34-25;2*1-2;/h10-20H,2-9H2,1H3;;;/q-2;;;+3/b22-21-,23-21-,30-24-,30-26-,31-25-,31-27-,32-28-,32-29-;;;
InChIKey PWTFYWSLYVKPKP-OLNQEWBESA-N
Mol Weight 578.5 g/mol
Molecular Formula C34H30FeN6
Exact Mass 578.188131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2GnDIe4Pw8k
Name DICYANO-(MESO-PROPYL-TRICYClOPROPYLPORPHYRINATO)-IRON-(III);FE(T(C)PRP)(CN)2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H30FeN6
InChI InChI=1S/C32H30N4.2CN.Fe/c1-2-3-21-22-10-12-24(33-22)30(18-4-5-18)26-14-16-28(35-26)32(20-8-9-20)29-17-15-27(36-29)31(19-6-7-19)25-13-11-23(21)34-25;2*1-2;/h10-20H,2-9H2,1H3;;;/q-2;;;+3/b22-21-,23-21-,30-24-,30-26-,31-25-,31-27-,32-28-,32-29-;;;
InChIKey PWTFYWSLYVKPKP-OLNQEWBESA-N
Literature Reference Author T.IKEUE,Y.OHGO,T.SAITOH,M.NAKAMURA,H.FUJII,M.YOKOYAMA
Literature Reference Citation J.AM.CHEM.SOC.,122,4068(2000)
Literature Reference DOI 10.1021/ja992219n
Molecular Weight 578.499 g/mol
Solvent CD2Cl2;LOW_SPIN_COMPLEX
Source File Reference UWLU4723