Molecule:100551: Difference between revisions
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molecule
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|trivialname= | |trivialname= | ||
|abbrev= | |abbrev= | ||
|molecularFormula= | |molecularFormula=C<sub>31</sub>H<sub>26</sub>*<sub>2</sub>ClN<sub>3</sub>O<sub>2</sub>P<sub>2</sub>Ru | ||
|hasVendors= | |hasVendors= | ||
|moleculeKey=C1C2N([*])P([Ru](C#O)(C#O)(Cl)3P(N([*])C(N=23)=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1r1 | |moleculeKey=C1C2N([*])P([Ru+](C#O)(C#O)([Cl-])3P(N([*])C(N=23)=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1r1 | ||
|molOrRxn= | |molOrRxn= | ||
-INDIGO- | -INDIGO-12162418092D | ||
0 0 0 0 0 0 0 0 0 0 0 V3000 | 0 0 0 0 0 0 0 0 0 0 0 V3000 | ||
| Line 47: | Line 47: | ||
M V30 33 N 4.46086 -4.54219 0.0 0 | M V30 33 N 4.46086 -4.54219 0.0 0 | ||
M V30 34 N 8.04897 -4.27423 0.0 0 | M V30 34 N 8.04897 -4.27423 0.0 0 | ||
M V30 35 Ru 6.24588 -5.12857 0.0 0 | M V30 35 Ru 6.24588 -5.12857 0.0 0 CHG=1 | ||
M V30 36 R# 9.03294 -3.92915 0.0 0 RGROUPS=(1 1) | M V30 36 R# 9.03294 -3.92915 0.0 0 RGROUPS=(1 1) | ||
M V30 37 R# 3.52683 -4.27654 0.0 0 RGROUPS=(1 1) | M V30 37 R# 3.52683 -4.27654 0.0 0 RGROUPS=(1 1) | ||
M V30 38 Cl 5.78499 -5.97349 0.0 0 | M V30 38 Cl 5.78499 -5.97349 0.0 0 CHG=-1 | ||
M V30 39 C 6.55546 -5.85874 0.0 0 | M V30 39 C 6.55546 -5.85874 0.0 0 | ||
M V30 40 C 6.83931 -4.72558 0.0 0 | M V30 40 C 6.83931 -4.72558 0.0 0 | ||
| Line 117: | Line 117: | ||
M END | M END | ||
|smiles=C1C2N([*])P([Ru](C#O)(C#O)(Cl)3P(N([*])C(N=23)=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1 | |smiles=C1C2N([*])P([Ru+](C#O)(C#O)([Cl-])3P(N([*])C(N=23)=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1 | ||
|inchi= | |inchi= | ||
|inchikey= | |inchikey= | ||
|width=300px | |width=300px | ||
|height= | |height=200px | ||
|float=none | |float=none | ||
|parent= | |parent= | ||
|molecularMass=671.023227312 | |||
}} | }} | ||
Latest revision as of 19:10, 16 December 2024
Click here to show SMILES and Molecule-Key.
R-Groups[edit source]
| Molecule | Publication | R1 |
|---|---|---|
| 100922 | Photocatalytic CO2 conversion to HCOOH | Me |
| 100921 | Photocatalytic CO2 conversion to HCOOH | H |
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