Exploring the Full Potential of Photocatalytic Carbon Dioxide Reduction Using a Dinuclear Re2Cl2 Complex Assisted by Various Photosensitizers: Difference between revisions

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DOI 10.1002/cptc.202100034
Authors Robin Giereth, Martin Obermeier, Lukas Forschner, Michael Karnahl, Matthias Schwalbe, Stefanie Tschierlei,
Submitted 17.03.2021
Published online 02.05.2021
Licenses http://creativecommons.org/licenses/by-nc-nd/4.0/, http://doi.wiley.com/10.1002/tdm_license_1.1,
Subjects Organic Chemistry, Physical and Theoretical Chemistry, Analytical Chemistry
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===Photosensitizer===
===Photosensitizer===
<chemform smiles="C1C(F)=C2C3N(~[Ir]4(~N5C(C6C~4=CC(F)=CC=6F)=CC=CC=5)4(~N5=C(C6C~4=CC(F)=CC=6F)C=CC=C5)~C2=CC=1F)=CC=CC=3" inchi="1S/3C11H6F2N.Ir/c3*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;/h3*1-4,6-7H;" inchikey="GFSFWLGQTIKUOK-UHFFFAOYSA-N" height="200px" width="300px" float="none">
<chemform smiles="C(F)1C2C3C=CC=CN=3[Ir+3]3(N4C=CC=CC=4C4=[C-]3C=C(F)C=C4F)3(N4C=CC=CC=4C4=[C-]3C=C(F)C=C4F)[C-]=2C=C(F)C=1" inchi="1S/3C11H6F2N.Ir/c3*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;/h3*1-4,6-7H;/q3*-1;+3" inchikey="GJHHESUUYZNNGV-UHFFFAOYSA-N" height="200px" width="300px" float="none">
  -INDIGO-07282313512D
 
  0  0  0  0  0  0  0  0  0  0  0 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 43 51 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 3.78642 -2.68028 0.0 0
M  V30 2 C 5.14056 -2.59641 0.0 0
M  V30 3 C 4.39175 -2.33383 0.0 0
M  V30 4 C 5.39789 -3.41526 0.0 0
M  V30 5 C 3.76842 -3.42982 0.0 0
M  V30 6 C 4.4835 -3.8551 0.0 0
M  V30 7 C 3.73664 -5.01965 0.0 0
M  V30 8 N 5.35444 -4.97348 0.0 0
M  V30 9 C 4.43228 -4.54824 0.0 0
M  V30 10 C 5.10543 -5.79993 0.0 0
M  V30 11 C 3.73151 -5.76259 0.0 0
M  V30 12 C 4.36622 -6.08796 0.0 0
M  V30 13 C 7.2832 -0.940455 0.0 0
M  V30 14 C 8.61297 -0.965021 0.0 0
M  V30 15 C 7.92272 -0.573435 0.0 0
M  V30 16 C 8.61778 -1.82708 0.0 0
M  V30 17 C 7.11761 -1.75223 0.0 0
M  V30 18 N 7.71814 -2.34174 0.0 0
M  V30 19 C 9.29248 -2.2044 0.0 0
M  V30 20 C 10.7832 -2.21732 0.0 0
M  V30 21 C 10.1139 -1.82797 0.0 0
M  V30 22 C 10.7529 -2.9821 0.0 0
M  V30 23 C 9.17767 -3.18644 0.0 0
M  V30 24 C 10.0599 -3.48219 0.0 0
M  V30 25 C 7.08042 -6.4184 0.0 0
M  V30 26 C 8.52181 -6.35762 0.0 0
M  V30 27 C 7.66571 -5.87255 0.0 0
M  V30 28 C 8.55837 -7.19865 0.0 0
M  V30 29 C 7.2437 -7.22819 0.0 0
M  V30 30 C 7.88629 -7.59686 0.0 0
M  V30 31 N 8.9695 -5.08761 0.0 0
M  V30 32 C 10.4599 -5.2986 0.0 0
M  V30 33 C 9.78563 -4.80293 0.0 0
M  V30 34 C 10.4979 -6.05696 0.0 0
M  V30 35 C 9.06602 -6.07601 0.0 0
M  V30 36 C 9.83633 -6.43736 0.0 0
M  V30 37 F 2.73044 -3.85065 0.0 0
M  V30 38 F 4.16936 -1.18429 0.0 0
M  V30 39 F 10.3333 -0.706651 0.0 0
M  V30 40 F 15.5714 -5.16166 0.0 0
M  V30 41 F 6.43004 -7.92497 0.0 0
M  V30 42 F 9.53926 -7.8578 0.0 0
M  V30 43 Ir 7.32951 -4.1406 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 3 1
M  V30 2 2 4 2
M  V30 3 1 1 5
M  V30 4 1 2 3
M  V30 5 2 5 6
M  V30 6 1 6 4
M  V30 7 2 9 7
M  V30 8 2 10 8
M  V30 9 1 7 11
M  V30 10 1 8 9
M  V30 11 2 11 12
M  V30 12 1 12 10
M  V30 13 2 15 13
M  V30 14 2 16 14
M  V30 15 1 13 17
M  V30 16 1 14 15
M  V30 17 2 17 18
M  V30 18 1 18 16
M  V30 19 2 21 19
M  V30 20 2 22 20
M  V30 21 1 19 23
M  V30 22 1 20 21
M  V30 23 2 23 24
M  V30 24 1 24 22
M  V30 25 2 27 25
M  V30 26 2 28 26
M  V30 27 1 25 29
M  V30 28 1 26 27
M  V30 29 2 29 30
M  V30 30 1 30 28
M  V30 31 1 33 31
M  V30 32 1 34 32
M  V30 33 2 31 35
M  V30 34 2 32 33
M  V30 35 1 35 36
M  V30 36 2 36 34
M  V30 37 1 6 9
M  V30 38 1 26 35
M  V30 39 1 16 19
M  V30 40 1 5 37
M  V30 41 1 3 38
M  V30 42 1 21 39
M  V30 43 1 22 40
M  V30 44 1 29 41
M  V30 45 1 28 42
M  V30 46 8 4 43
M  V30 47 8 8 43
M  V30 48 8 27 43
M  V30 49 8 31 43
M  V30 50 8 23 43
M  V30 51 8 18 43
M  V30 END BOND
M  V30 END CTAB
M  END
</chemform><chemform smiles="C(F)1C2C3C=CC=CN=3[Ir+3]3(N4C=CC=CC=4C4=[C-]3C=C(F)C=C4F)3(N4C=CC=CC=4C4=[C-]3C=C(F)C=C4F)[C-]=2C=C(F)C=1" inchi="1S/3C11H6F2N.Ir/c3*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;/h3*1-4,6-7H;/q3*-1;+3" inchikey="GJHHESUUYZNNGV-UHFFFAOYSA-N" height="200px" width="300px" float="none">
   -INDIGO-11272314332D
   -INDIGO-11272314332D


Revision as of 15:00, 27 November 2023


WikiTemplate chemistry.pngFaulty molecule
A molecule on this page has a mistake in its structure or is missing a part. Please edit the structure or redraw a new molecule using the replace molecule workflow.

Catalyst

Molecule with key SPPICNUXBVPFDY-UHFFFAOYSA-N does not exist.

Photosensitizer

Ir(fppy)3 [Cu(bcp)(xant)][PF6]

Investigation

  1. REDIRECT Optimizations of the conditions
Investigation-Name: Table 1

Sacrificial electron donor

TEABIH

Investigations

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