Molecule:100787: Difference between revisions

InChI	1S/3C10H8N2.2ClH.Ru/c31-3-7-11-9(5-1)10-6-2-4-8-12-10;;;/h31-8H;2*1H;/q;;;;;+2/p-2
InChI-Key	SJFYGUKHUNLZTK-UHFFFAOYSA-L
SMILES	C1C2C3C=CC=CN=3[Ru+2]3(N4C=CC=CC=4C4N3=CC=CC=4)3(N4C=CC=CC=4C4N3=CC=CC=4)N=2C=CC=1.[Cl-].[Cl-]

Properties
CID	84353
CAS	14323-06-9
IUPAC-Name	2-pyridin-2-ylpyridine;ruthenium(2+);dichloride
Abbreviation	Ru(bpy)3Cl2
Trivialname	tris(22'-bipyridine)ruthenium dichloride
Exact mass	640.048290
Molecular formula	C30H24Cl2N6Ru
LogP	n/a
Has vendors	true
Molecular role	n/a
Synonyms	tris(22'-bipyridine)ruthenium dichloride,alf8b3wyc2,tris(22'-bipyridyl)ruthenium(ii) chloride,einecs 238-266-7,nsc 71326,ruthenium tris(22'-bipyridine)- dichloride,ruthenium(2+) tris(22'-bipyridine)- dichloride,tris22'-bipyridineruthenium dichloride,tris(22'-bipyridine)ruthenium(ii) dichloride,ruthenium(2+) tris(22'-bipyridine-.kappa.n1.kappa.n1')- dichloride (oc-6-11)-

Revision as of 10:26, 17 January 2024

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Ru(bpy)3Cl2

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Click here to show SMILES and InChI.

‎

Molecule is used on following pages

topic

publication

Visible-Light-Driven Photocatalytic CO2 Reduction by a Ni(II) Complex Bearing a Bioinspired Tetradentate Ligand for Selective CO Production
Pyranopterin Related Dithiolene Molybdenum Complexes as Homogeneous Catalysts for CO2 Photoreduction
Highly Efficient and Selective Photocatalytic CO2 Reduction by Iron and Cobalt Quaterpyridine Complexes
Mn-carbonyl molecular catalysts containing a redox-active phenanthroline-5,6-dione for selective electro- and photoreduction of CO2 to CO or HCOOH

investigation

Molecule roles

Investigation type	Photosensitizer
Photocatalytic CO2 conversion experiments	Optimizations of conditions for Co(qpy)(H2O)2(ClO4)2 and Ru(bpy)3Cl2 Optimizations of conditions for Fe(qpy)(H2O)2(ClO4)2 and Ru(bpy)3Cl2 Optimizations of conditions for Fe(qpy)(H2O)2(ClO4)2 Table 1 Table 1 Table 1
Cyclic Voltammetry experiments

@@ Line 11: / Line 11: @@
 |moleculeKey=SJFYGUKHUNLZTK-UHFFFAOYSA-L
 |molOrRxn=
-   -INDIGO-11272316582D
+   -INDIGO-08112312492D
   0  0  0  0  0  0  0  0  0  0 V3000
@@ Line 17: / Line 17: @@
 M  V30 COUNTS 39 45 0 0 0
 M  V30 BEGIN ATOM
-M  V30 1 C 8.38485 -1.67507 0.0 0
+M  V30 1 C 7.18485 -2.40007 0.0 0
-M  V30 2 C 10.1152 -1.67459 0.0 0
+M  V30 2 C 8.91515 -2.39959 0.0 0
-M  V30 3 C 9.25164 -1.17497 0.0 0
+M  V30 3 C 8.05164 -1.89997 0.0 0
-M  V30 4 C 10.1152 -2.67553 0.0 0
+M  V30 4 C 8.91515 -3.40053 0.0 0
-M  V30 5 C 8.38485 -2.68002 0.0 0
+M  V30 5 C 7.18485 -3.40502 0.0 0
-M  V30 6 N 9.25382 -3.17503 0.0 0
+M  V30 6 N 8.05382 -3.90003 0.0 0
-M  V30 7 C 10.9812 -3.17553 0.0 0
+M  V30 7 C 6.32028 -3.90753 0.0 0
-M  V30 8 C 12.7115 -3.17389 0.0 0
+M  V30 8 C 5.4609 -5.40933 0.0 0
-M  V30 9 C 11.8476 -2.67484 0.0 0
+M  V30 9 N 6.32356 -4.90824 0.0 0
-M  V30 10 C 12.7121 -4.17483 0.0 0
+M  V30 10 C 4.59227 -4.91195 0.0 0
-M  V30 11 N 10.9818 -4.18048 0.0 0
+M  V30 11 C 5.44818 -3.40816 0.0 0
-M  V30 12 C 11.8512 -4.67491 0.0 0
+M  V30 12 C 4.58681 -3.91628 0.0 0
-M  V30 13 N 10.9848 -6.20007 0.0 0
+M  V30 13 C 5.464 -6.40932 0.0 0
-M  V30 14 C 12.7152 -6.19959 0.0 0
+M  V30 14 C 6.33521 -7.90429 0.0 0
-M  V30 15 C 11.8516 -5.69997 0.0 0
+M  V30 15 N 6.33238 -6.90666 0.0 0
-M  V30 16 C 12.7152 -7.20053 0.0 0
+M  V30 16 C 5.47026 -8.40803 0.0 0
-M  V30 17 C 10.9848 -7.20502 0.0 0
+M  V30 17 C 4.59559 -6.91507 0.0 0
-M  V30 18 C 11.8538 -7.70003 0.0 0
+M  V30 18 C 4.60515 -7.9151 0.0 0
-M  V30 19 C 10.1188 -7.70502 0.0 0
+M  V30 19 C 7.20288 -8.40143 0.0 0
-M  V30 20 C 9.2551 -9.20433 0.0 0
+M  V30 20 C 8.93317 -8.39406 0.0 0
-M  V30 21 C 10.1192 -8.70573 0.0 0
+M  V30 21 N 8.06768 -7.89788 0.0 0
-M  V30 22 C 8.38792 -8.70444 0.0 0
+M  V30 22 C 8.93715 -9.39499 0.0 0
-M  V30 23 N 9.24818 -7.20313 0.0 0
+M  V30 23 C 7.20688 -9.40636 0.0 0
-M  V30 24 C 8.38534 -7.70875 0.0 0
+M  V30 24 C 8.07781 -9.89792 0.0 0
-M  V30 25 C 5.70985 -6.27507 0.0 0
+M  V30 25 C 9.79743 -7.89102 0.0 0
-M  V30 26 N 7.44015 -6.27459 0.0 0
+M  V30 26 C 10.6559 -6.38869 0.0 0
-M  V30 27 C 6.57664 -5.77497 0.0 0
+M  V30 27 N 9.79354 -6.89032 0.0 0
-M  V30 28 C 7.44015 -7.27553 0.0 0
+M  V30 28 C 11.5248 -6.88554 0.0 0
-M  V30 29 C 5.70985 -7.28002 0.0 0
+M  V30 29 C 10.6698 -8.38985 0.0 0
-M  V30 30 C 6.57882 -7.77503 0.0 0
+M  V30 30 C 11.5309 -7.8812 0.0 0
-M  V30 31 C 6.57664 -4.77497 0.0 0
+M  V30 31 C 10.6522 -5.3887 0.0 0
-M  V30 32 C 5.71006 -3.2773 0.0 0
+M  V30 32 C 9.78004 -3.89427 0.0 0
-M  V30 33 C 5.7098 -4.27494 0.0 0
+M  V30 33 N 9.78349 -4.8919 0.0 0
-M  V30 34 C 6.57657 -2.77625 0.0 0
+M  V30 34 C 10.6447 -3.39 0.0 0
-M  V30 35 N 7.44661 -4.27191 0.0 0
+M  V30 35 C 11.5203 -4.88241 0.0 0
-M  V30 36 C 7.44015 -3.27186 0.0 0
+M  V30 36 C 11.5101 -3.88239 0.0 0
-M  V30 37 Ru 9.21263 -5.19691 0.0 0 CHG=2
+M  V30 37 Ru 8.05382 -5.85003 0.0 0 CHG=2
-M  V30 38 Cl 14.05 -1.95 0.0 0 CHG=-1
+M  V30 38 Cl 10.05 -2.325 0.0 0 CHG=-1
-M  V30 39 Cl 14.1 -3.225 0.0 0 CHG=-1
+M  V30 39 Cl 3.975 -5.9 0.0 0 CHG=-1
 M  V30 END ATOM
 M  V30 BEGIN BOND
@@ Line 64: / Line 64: @@
 M  V30 5 2 5 6
 M  V30 6 1 6 4
-M  V30 7 1 4 7
+M  V30 7 1 5 7
 M  V30 8 2 9 7
 M  V30 9 2 10 8
@@ Line 77: / Line 77: @@
 M  V30 18 2 17 18
 M  V30 19 1 18 16
-M  V30 20 1 17 19
+M  V30 20 1 14 19
 M  V30 21 2 21 19
 M  V30 22 2 22 20
@@ Line 90: / Line 90: @@
 M  V30 31 2 29 30
 M  V30 32 1 30 28
-M  V30 33 1 27 31
+M  V30 33 1 26 31
 M  V30 34 2 33 31
 M  V30 35 2 34 32
@@ Line 97: / Line 97: @@
 M  V30 38 2 35 36
 M  V30 39 1 36 34
-M  V30 40 10 35 37
+M  V30 40 10 6 37
-M  V30 41 10 6 37
+M  V30 41 10 37 9
-M  V30 42 10 37 11
+M  V30 42 10 15 37
-M  V30 43 10 13 37
+M  V30 43 10 37 21
-M  V30 44 10 37 23
+M  V30 44 10 27 37
-M  V30 45 10 26 37
+M  V30 45 10 37 33
 M  V30 END BOND
 M  V30 END CTAB
 M  END
-|smiles=C1C=N2[Ru+2]3(N4C(C5N3=CC=CC=5)=CC=CC=4)3(N4=CC=CC=C4C4=CC=CC=N43)N3=CC=CC=C3C2=CC=1.[Cl-].[Cl-]
+|smiles=C1C2C3C=CC=CN=3[Ru+2]3(N4C=CC=CC=4C4N3=CC=CC=4)3(N4C=CC=CC=4C4N3=CC=CC=4)N=2C=CC=1.[Cl-].[Cl-]
 |inchi=1S/3C10H8N2.2ClH.Ru/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;/h3*1-8H;2*1H;/q;;;;;+2/p-2
 |inchikey=SJFYGUKHUNLZTK-UHFFFAOYSA-L

Molecule:100787: Difference between revisions

Revision as of 10:26, 17 January 2024

Molecule is used on following pages

Molecule roles

Current site

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