Molecule:100987: Difference between revisions

InChI	1S/C39H32O7P2S2.C26H20N2O6S2.BF4.Cu.4Na/c1-39(2)33-23-31(49(40,41)42)25-35(47(27-15-7-3-8-16-27)28-17-9-4-10-18-28)37(33)46-38-34(39)24-32(50(43,44)45)26-36(38)48(29-19-11-5-12-20-29)30-21-13-6-14-22-30;1-15-13-19(17-9-5-3-6-10-17)21-23(27-15)24-22(26(36(32,33)34)25(21)35(29,30)31)20(14-16(2)28-24)18-11-7-4-8-12-18;2-1(3,4)5;;;;;/h3-26H,1-2H3,(H,40,41,42)(H,43,44,45);3-14H,1-2H3,(H,29,30,31)(H,32,33,34);;;;;;/q;;2-1;4+1/p-2
InChI-Key	GPJHXPCFGPLTHZ-UHFFFAOYSA-L
SMILES	C1(C=C(C)N2~[Cu+](~N3C4C=2C=1C(=C(C=4C(=CC=3C)C1C=CC=CC=1)S([O-])(=O)=O)S([O-])(=O)=O)1~P(C2C=C(C=C3C(C)(C)C4=CC(=CC(P~1(C1C=CC=CC=1)C1C=CC=CC=1)=C4OC3=2)S([O-])(=O)=O)S([O-])(=O)=O)(C1C=CC=CC=1)C1C=CC=CC=1)C1C=CC=CC=1.[B-](F)(F)(F)F.[Na+].[Na+].[Na+].[Na+]

Properties
CID	n/a
CAS	n/a
IUPAC-Name	n/a
Abbreviation	n/a
Trivialname	n/a
Exact mass	n/a
Molecular formula	n/a
LogP	n/a
Has vendors	n/a
Molecular role	n/a
Synonyms	n/a

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Latest revision as of 11:44, 21 November 2025

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100987

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Molecule is used on following pages

publication

Photochemical CO2 Reduction Driven by Water-Soluble Copper(I) Photosensitizer with the Catalysis Accelerated by Multi-Electron Chargeable Cobalt Porphyrin

investigation

Photochemical CO2 Reduction Driven by Water-Soluble Copper(I) Photosensitizer with the Catalysis Accelerated by Multi-Electron Chargeable Cobalt Porphyrin/Tabel 1

Molecule roles

Investigation type	Photosensitizer
Photocatalytic CO2 conversion experiments	Tabel 1
Cyclic Voltammetry experiments
Absorption Emission Spectroscopy experiments
Ultraviolett Visuell experiments

@@ Line 2: / Line 2: @@
 |trivialname=
 |abbrev=
-|molecularFormula=C<sub>65</sub>H<sub>48</sub>CuN<sub>2</sub>O<sub>13</sub>P<sub>2</sub>S<sub>4</sub>-<sub>4</sub>
+|molecularFormula=
-|molecularMass=1317.0832386756
+|molecularMass=
 |synonyms=
 |hasVendors=
-|moleculeKey=PDVCFPPNDZGLBQ-UHFFFAOYSA-L
+|moleculeKey=GPJHXPCFGPLTHZ-UHFFFAOYSA-L
 |molOrRxn=
-   -INDIGO-12162416542D
+   -INDIGO-01102515402D
   0  0  0  0  0  0  0  0  0  0 V3000
 M  V30 BEGIN CTAB
-M  V30 COUNTS 87 100 6 0 0
+M  V30 COUNTS 96 104 6 0 0
 M  V30 BEGIN ATOM
 M  V30 1 C -2.56114 1.6625 0.0 0
@@ Line 30: / Line 30: @@
 M  V30 15 C -0.410401 2.07581 0.0 0
 M  V30 16 C -0.410401 -2.0635 0.0 0
-M  V30 17 Cu 1.45104 -0.076391 0.0 0
+M  V30 17 Cu 1.45104 -0.076391 0.0 0 CHG=1
 M  V30 18 C 6.5811 0.015442 0.0 0
 M  V30 19 C 6.1671 0.458868 0.0 0
@@ Line 93: / Line 93: @@
 M  V30 78 O 6.16951 -2.47778 0.0 0
 M  V30 79 O 7.33141 -2.47778 0.0 0 CHG=-1
-M  V30 80 S -4.49275 1.08302 0.0 0
+M  V30 80 S -3.99275 0.833017 0.0 0
-M  V30 81 O -4.90356 0.371507 0.0 0
+M  V30 81 O -4.40356 0.121507 0.0 0
-M  V30 82 O -4.08194 1.79453 0.0 0
+M  V30 82 O -3.58194 1.54453 0.0 0
-M  V30 83 O -5.20426 1.49383 0.0 0 CHG=-1
+M  V30 83 O -4.70426 1.24383 0.0 0 CHG=-1
-M  V30 84 S -4.29275 -0.995015 0.0 0
+M  V30 84 S -3.99275 -0.820015 0.0 0
-M  V30 85 O -3.88194 -1.70653 0.0 0
+M  V30 85 O -3.58194 -1.53153 0.0 0
-M  V30 86 O -4.70356 -0.283505 0.0 0
+M  V30 86 O -4.40356 -0.108505 0.0 0
-M  V30 87 O -5.00426 -1.40583 0.0 0 CHG=-1
+M  V30 87 O -4.70426 -1.23083 0.0 0 CHG=-1
+M  V30 88 B 1.21699 -3.525 0.0 0 CHG=-1
+M  V30 89 F 2.08301 -3.025 0.0 0
+M  V30 90 F 1.21699 -2.525 0.0 0
+M  V30 91 F 0.251061 -3.78382 0.0 0
+M  V30 92 F 1.92409 -4.23211 0.0 0
+M  V30 93 Na 8.1 2.5 0.0 0 CHG=1
+M  V30 94 Na 7.875 -1.975 0.0 0 CHG=1
+M  V30 95 Na -4.625 -1.75 0.0 0 CHG=1
+M  V30 96 Na -4.5 1.925 0.0 0 CHG=1
 M  V30 END ATOM
 M  V30 BEGIN BOND
@@ Line 203: / Line 212: @@
 M  V30 99 8 4 17
 M  V30 100 8 14 17
+M  V30 101 1 88 89
+M  V30 102 1 88 90
+M  V30 103 1 88 91
+M  V30 104 1 88 92
 M  V30 END BOND
 M  V30 BEGIN SGROUP
@@ Line 232: / Line 245: @@
 M  V30 END CTAB
 M  END
+|smiles=C1(C=C(C)N2~[Cu+](~N3C4C=2C=1C(=C(C=4C(=CC=3C)C1C=CC=CC=1)S([O-])(=O)=O)S([O-])(=O)=O)1~P(C2C=C(C=C3C(C)(C)C4=CC(=CC(P~1(C1C=CC=CC=1)C1C=CC=CC=1)=C4OC3=2)S([O-])(=O)=O)S([O-])(=O)=O)(C1C=CC=CC=1)C1C=CC=CC=1)C1C=CC=CC=1.[B-](F)(F)(F)F.[Na+].[Na+].[Na+].[Na+]
-|smiles=C1(C=C(C)N2~[Cu](~N3C4C=2C=1C(=C(C=4C(=CC=3C)C1C=CC=CC=1)S([O-])(=O)=O)S([O-])(=O)=O)1~P(C2C=C(C=C3C(C)(C)C4=CC(=CC(P~1(C1C=CC=CC=1)C1C=CC=CC=1)=C4OC3=2)S([O-])(=O)=O)S([O-])(=O)=O)(C1C=CC=CC=1)C1C=CC=CC=1)C1C=CC=CC=1
+|inchi=1S/C39H32O7P2S2.C26H20N2O6S2.BF4.Cu.4Na/c1-39(2)33-23-31(49(40,41)42)25-35(47(27-15-7-3-8-16-27)28-17-9-4-10-18-28)37(33)46-38-34(39)24-32(50(43,44)45)26-36(38)48(29-19-11-5-12-20-29)30-21-13-6-14-22-30;1-15-13-19(17-9-5-3-6-10-17)21-23(27-15)24-22(26(36(32,33)34)25(21)35(29,30)31)20(14-16(2)28-24)18-11-7-4-8-12-18;2-1(3,4)5;;;;;/h3-26H,1-2H3,(H,40,41,42)(H,43,44,45);3-14H,1-2H3,(H,29,30,31)(H,32,33,34);;;;;;/q;;2*-1;4*+1/p-2
-|inchi=1S/C39H32O7P2S2.C26H20N2O6S2.Cu/c1-39(2)33-23-31(49(40,41)42)25-35(47(27-15-7-3-8-16-27)28-17-9-4-10-18-28)37(33)46-38-34(39)24-32(50(43,44)45)26-36(38)48(29-19-11-5-12-20-29)30-21-13-6-14-22-30;1-15-13-19(17-9-5-3-6-10-17)21-23(27-15)24-22(26(36(32,33)34)25(21)35(29,30)31)20(14-16(2)28-24)18-11-7-4-8-12-18;/h3-26H,1-2H3,(H,40,41,42)(H,43,44,45);3-14H,1-2H3,(H,29,30,31)(H,32,33,34);/q;;-2/p-2
+|inchikey=GPJHXPCFGPLTHZ-UHFFFAOYSA-L
-|inchikey=PDVCFPPNDZGLBQ-UHFFFAOYSA-L
+|width=200
-|width=300px
+|height=200
-|height=200px
 |float=none
 |parent=
 }}

Molecule:100987: Difference between revisions

Latest revision as of 11:44, 21 November 2025

Molecule is used on following pages

Molecule roles

Records for role ""

Topics

Molecule:100987: Difference between revisions

Latest revision as of 11:44, 21 November 2025

Molecule is used on following pages

Molecule roles

Records for role ""

Current site

Topics