HRID 1812461als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
Grundinformationen
- Standard-SMILES
F[P-](F)(F)(F)(F)F.[Ir+3].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.c1ccc(-c2ccccn2)nc1- InChIKey
RJJGJTKSOSSNNL-UHFFFAOYSA-N- Summenformel
- C32H24F6IrN4P
- Durchschnittliche Molmasse
- 801,7 g/mol
- Monoisotopische Masse
- 802,1272
Namen und Bezeichner
- Bevorzugter Name
- Iridium(3+);2-phenylpyridine;2-pyridin-2-ylpyridine;hexafluorophosphate
- IUPAC
- iridium(3+);bis(2-phenylpyridine);2-pyridin-2-ylpyridine;hexafluorophosphate
Namen und Synonyme
SCHEMBL25384664B4893W19685iridium(3+);2-phenylpyridine;2-pyridin-2-ylpyridine;hexafluorophosphateIridium ((2,2-Bipyridine-N,N)bis[2-(2-pyridinyl)phenyl-C,N] Hexaflouorophosphate
Datenbank-Bezeichner
- PubChem CID
- 54589530
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 51,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 13
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 44
- Formalladung
- 0
- Komplexität
- 711
Zugehörige Reaktionen
110
HRID 1812462als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812463als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812464als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812465als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812466als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812467als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
HRID 1812468als KatalysatorDataset from `Ultra-high-throughput mapping of the chemical space of asymmetric catalysis enables accelerated reaction discovery`
Verknüpfte Notizen
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