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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M  V30 END CTAB
M  V30 END CTAB
M  END
M  END
</chemform><chemform smiles="C1C=C2C(C3C=CC=CC=3)=CC=N3[Cu]4(P(C5C=CC=CC=5)(C5C=CC=CC=5)C5C6OC7C(P4(C4C=CC=CC=4)C4C=CC=CC=4)=CC=CC=7C(C)(C)C=6C=CC=5)N4=CC=C(C5C=CC=CC=5)C=1C4=C23" inchi="1S/C39H32OP2.C24H16N2.Cu/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;/h3-28H,1-2H3;1-16H;" inchikey="AOHIOJWCMCHFIO-UHFFFAOYSA-N" height="200px" width="300px" float="none">
</chemform><chemform smiles="C1C=C2C(C3C=CC=CC=3)=CC=N3[Cu+]4(P(C5C=CC=CC=5)(C5C=CC=CC=5)C5C6OC7C(P4(C4C=CC=CC=4)C4C=CC=CC=4)=CC=CC=7C(C)(C)C=6C=CC=5)N4=CC=C(C5C=CC=CC=5)C=1C4=C23.[P-](F)(F)(F)(F)(F)F" inchi="1S/C39H32OP2.C24H16N2.Cu.F6P/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;;1-7(2,3,4,5)6/h3-28H,1-2H3;1-16H;;/q;;+1;-1" inchikey="RLYPDFWLVSLBDF-UHFFFAOYSA-N" height="200px" width="300px" float="none">
   -INDIGO-11272314422D
   -INDIGO-11272314442D


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   0  0  0  0  0  0  0  0  0  0  0 V3000
M  V30 BEGIN CTAB
M  V30 BEGIN CTAB
M  V30 COUNTS 69 82 0 0 0
M  V30 COUNTS 76 88 0 0 0
M  V30 BEGIN ATOM
M  V30 BEGIN ATOM
M  V30 1 C 4.75985 -5.47507 0.0 0
M  V30 1 C 4.75985 -5.47507 0.0 0
Line 479: Line 479:
M  V30 67 C 14.6321 -5.3429 0.0 0
M  V30 67 C 14.6321 -5.3429 0.0 0
M  V30 68 C 14.6321 -6.75712 0.0 0
M  V30 68 C 14.6321 -6.75712 0.0 0
M  V30 69 Cu 8.52413 -5.87422 0.0 0
M  V30 69 Cu 8.52413 -5.87422 0.0 0 CHG=1
M  V30 70 P 15.625 -2.175 0.0 0 CHG=-1
M  V30 71 F 15.625 -1.175 0.0 0
M  V30 72 F 14.759 -2.675 0.0 0
M  V30 73 F 16.491 -2.675 0.0 0
M  V30 74 F 16.491 -1.675 0.0 0
M  V30 75 F 15.625 -3.175 0.0 0
M  V30 76 F 14.759 -1.675 0.0 0
M  V30 END ATOM
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 BEGIN BOND
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M  V30 81 10 69 42
M  V30 81 10 69 42
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M  V30 83 1 70 71
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M  V30 85 1 70 73
M  V30 86 1 70 74
M  V30 87 1 70 75
M  V30 88 1 70 76
M  V30 END BOND
M  V30 END BOND
M  V30 END CTAB
M  V30 END CTAB

Revision as of 14:44, 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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