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Structure

3-Di-i-propylphosphino-2-(N,N-dimethylamino)-1H-indene(1,5-cyclooctadiene)iridium(I) hexafluorophosphate, min. 98%

CAS
870077-94-4
Catalog Number
ACM870077944
Category
Iridium series of catalysts
Molecular Weight
720.741g/mol
Molecular Formula
C25H38F6IrNP2-;

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Specification

Synonyms
870077-94-4;3-Di-i-propylphosphino-2-(N,N-dimethylamino)-1H-indene(1,5-cyclooctadiene)iridium(I) hexafluorophosphate;(1Z,5Z)-cycloocta-1,5-diene;3-di(propan-2-yl)phosphanyl-N,N-dimethyl-1H-inden-2-amine;iridium;hexafluorophosphate;
IUPAC Name
cycloocta-1,5-diene;3-di(propan-2-yl)phosphanyl-N,N-dimethyl-1H-inden-2-amine;iridium;hexafluorophosphate;
Canonical SMILES
CC(C)P(C1=C(CC2=CC=CC=C21)N(C)C)C(C)C.C1CC=CCCC=C1.F[P-](F)(F)(F)(F)F.[Ir];
InChI
InChI=1S/C17H26NP.C8H12.F6P.Ir/c1-12(2)19(13(3)4)17-15-10-8-7-9-14(15)11-16(17)18(5)6;1-2-4-6-8-7-5-3-1;1-7(2,3,4,5)6;/h7-10,12-13H,11H2,1-6H3;1-2,7-8H,3-6H2;;/q;;-1;;
InChI Key
MMDIEIPTBOTQOH-UHFFFAOYSA-N;
Application
Zwitterionic hydrogenation, hydrosilylation and hydroboration catalyst soluble in non-polar solvents.
Complexity
471
Covalently-Bonded Unit Count
4
Exact Mass
721.201g/mol
Formal Charge
-1
H-Bond Acceptor
8
Heavy Atom Count
35
Monoisotopic Mass
721.201g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
3.2A^2
Undefined Bond Stereocenter Count
2
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