Molecule:100752: Difference between revisions

InChI	InChI=1S/C10H8N2.3CO.BrH.Mn/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;3*1-2;;/h1-8H;;;;1H;/q;;;;;+1/p-1
InChI-Key	ZUZWBGQHMPVNDY-UHFFFAOYSA-M
SMILES	[O+]#[C-]~[Mn+]1(~[Br-])(~[C-]#[O+])(~[C-]#[O+])~n2ccccc2-c2ccccn~12

Properties
CID	n/a
CAS	n/a
IUPAC-Name	n/a
Abbreviation	Mn(bpy)(CO)3Br
Trivialname	n/a
Exact mass	373.909874316
Molecular formula	C13H8BrMnN2O3
LogP	n/a
Has vendors	n/a
Molecular role	n/a
Synonyms	n/a

← Older edit Newer edit →

VisualWikitext

Revision as of 16:21, 10 January 2024

‎

Mn(bpy)(CO)3Br

Click here to copy MOL-file.

Click here to show SMILES and InChI.

Belongs to molecule collection: Molecule collection 100751 ‎

Molecule is used on following pages

topic

publication

Highly Efficient and Robust Photocatalytic Systems for CO2 Reduction Consisting of a Cu(I) Photosensitizer and Mn(I) Catalysts
Mn-carbonyl molecular catalysts containing a redox-active phenanthroline-5,6-dione for selective electro- and photoreduction of CO2 to CO or HCOOH
Photocatalytic CO2 reduction using a Mn complex as a catalyst
Visible light driven reduction of CO2 catalyzed by an abundant manganese catalyst with zinc porphyrin photosensitizer

investigation

Molecule roles

Investigation type	Catalyst
Photocatalytic CO2 conversion experiments	Photocatalytic CO2 reduction with the Mn complexes under various conditions. Photocatalytic CO2 reduction: conditions optimization Results for photocatalytic reduction of CO2 Table 1
Cyclic Voltammetry experiments
Absorption Emission Spectroscopy experiments
Ultraviolett Visuell experiments

@@ Line 5: / Line 5: @@
 |moleculeKey=ZUZWBGQHMPVNDY-UHFFFAOYSA-M
 |molOrRxn=
-  -INDIGO-01102415542D
+     RDKit          2D
-  0  0  0  0  0  0  0  0  0  0 V3000
+  0  0  0  0  0  0  0  0  0999 V3000
 M  V30 BEGIN CTAB
 M  V30 COUNTS 20 22 0 0 0
 M  V30 BEGIN ATOM
-M  V30 1 C 5.25985 -3.0 0.0 0
+M  V30 1 C 4.75985 -3.47507 0 0
-M  V30 2 C 6.99015 -2.99959 0.0 0
+M  V30 2 C 6.49015 -3.47459 0 0
-M  V30 3 C 6.12664 -2.49997 0.0 0
+M  V30 3 C 5.62664 -2.97497 0 0
-M  V30 4 N 6.99015 -4.00053 0.0 0
+M  V30 4 N 6.49015 -4.47553 0 0
-M  V30 5 C 5.25985 -4.00502 0.0 0
+M  V30 5 C 4.75985 -4.48002 0 0
-M  V30 6 C 6.12882 -4.50003 0.0 0
+M  V30 6 C 5.62882 -4.97503 0 0
-M  V30 7 C 6.12882 -5.50003 0.0 0
+M  V30 7 C 4.75985 -6.42507 0 0
-M  V30 8 C 6.9954 -6.99769 0.0 0
+M  V30 8 N 6.49015 -6.42459 0 0
-M  V30 9 N 6.99566 -6.0 0.0 0
+M  V30 9 C 5.62664 -5.92497 0 0
-M  V30 10 C 6.12889 -7.49875 0.0 0
+M  V30 10 C 6.49015 -7.42553 0 0
-M  V30 11 C 5.25885 -6.00309 0.0 0
+M  V30 11 C 4.75985 -7.43002 0 0
-M  V30 12 C 5.26531 -7.00314 0.0 0
+M  V30 12 C 5.62882 -7.92503 0 0
-M  V30 13 Mn 8.025 -5.0 0.0 0 CHG=1
+M  V30 13 Mn 7.55 -5.475 0 0 CHG=1
-M  V30 14 C 8.025 -6.275 0.0 0 CHG=-1
+M  V30 14 C 8.41603 -4.975 0 0 CHG=-1
-M  V30 15 C 9.11603 -5.75 0.0 0 CHG=-1
+M  V30 15 C 8.41603 -5.975 0 0 CHG=-1
-M  V30 16 C 9.08211 -4.01789 0.0 0 CHG=-1
+M  V30 16 C 7.55 -6.475 0 0 CHG=-1
-M  V30 17 Br 8.025 -3.775 0.0 0 CHG=-1
+M  V30 17 O 7.55 -7.475 0 0 CHG=1
-M  V30 18 O 8.025 -7.275 0.0 0 CHG=1
+M  V30 18 O 9.28205 -6.475 0 0 CHG=1
-M  V30 19 O 9.98205 -6.25 0.0 0 CHG=1
+M  V30 19 O 9.28205 -4.475 0 0 CHG=1
-M  V30 20 O 9.78921 -3.31079 0.0 0 CHG=1
+M  V30 20 Br 7.525 -3.3 0 0 CHG=-1
 M  V30 END ATOM
 M  V30 BEGIN BOND
-M  V30 1 2 3 1
+M  V30 1 4 3 1
-M  V30 2 2 4 2
+M  V30 2 4 4 2
-M  V30 3 1 1 5
+M  V30 3 4 1 5
-M  V30 4 1 2 3
+M  V30 4 4 2 3
-M  V30 5 2 5 6
+M  V30 5 4 5 6
-M  V30 6 1 6 4
+M  V30 6 4 6 4
-M  V30 7 1 6 7
+M  V30 7 4 9 7
-M  V30 8 2 9 7
+M  V30 8 4 10 8
-M  V30 9 2 10 8
+M  V30 9 4 7 11
-M  V30 10 1 7 11
+M  V30 10 4 8 9
-M  V30 11 1 8 9
+M  V30 11 4 11 12
-M  V30 12 2 11 12
+M  V30 12 4 12 10
-M  V30 13 1 12 10
+M  V30 13 1 6 9
 M  V30 14 10 4 13
-M  V30 15 10 9 13
+M  V30 15 10 8 13
 M  V30 16 10 13 14
 M  V30 17 10 13 15
 M  V30 18 10 13 16
-M  V30 19 10 13 17
+M  V30 19 3 16 17
-M  V30 20 3 14 18
+M  V30 20 3 15 18
-M  V30 21 3 15 19
+M  V30 21 3 14 19
-M  V30 22 3 16 20
+M  V30 22 10 13 20
 M  V30 END BOND
 M  V30 END CTAB
 M  END
+|smiles=[O+]#[C-]~[Mn+]1(~[Br-])(~[C-]#[O+])(~[C-]#[O+])~n2ccccc2-c2ccccn~12
-|smiles=C1C=C2C3C=CC=CN=3[Mn+]([Br-])([C-]#[O+])([C-]#[O+])([C-]#[O+])N2=CC=1
+|inchi=InChI=1S/C10H8N2.3CO.BrH.Mn/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;3*1-2;;/h1-8H;;;;1H;/q;;;;;+1/p-1
-|inchi=1S/C10H8N2.3CO.BrH.Mn/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;3*1-2;;/h1-8H;;;;1H;/q;;;;;+1/p-1
 |inchikey=ZUZWBGQHMPVNDY-UHFFFAOYSA-M
-|width=300px
+|width=200
-|height=200px
+|height=200
 |float=none
 |trivialname=
 |synonyms=
 |hasVendors=
-|parent=
+|parent=Molecule:100751
 }}

Molecule:100752: Difference between revisions

Revision as of 16:21, 10 January 2024

Molecule is used on following pages

Molecule roles

Records for role ""

Topics

Molecule:100752: Difference between revisions

Revision as of 16:21, 10 January 2024

Molecule is used on following pages

Molecule roles

Records for role ""

Current site

Topics