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- (2S,2'S-(-)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate
(2S,2'S-(-)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate
PRICE INQUIRYCatalog Number
ACM959395109
Product Name
(2S,2'S-(-)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate
CAS
959395-10-9
Synonyms
PUBCHEM_44817506; DTXSID30660717; (2S,2'S-(-)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate; [Fe(S,S-PDP)(CH3CN)2](SbF6)2; [Fe(R,R-PDP)(CH3CN)2](SbF6)2; White-Chen catalyst; Iron(II) (R,R-(2-({(R)-2-[(R)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl}methyl)pyridine)(bis-acetonitrile) hexafluoroantimonate; 959395-10-9; Fe(R,R-PDP) White-Chen Catalyst;
IUPAC Name
acetonitrile;hexafluoroantimony(1-);iron(2+);2-[[(2R)-2-[(2R)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]pyridine;
Molecular Weight
931.908g/mol
Molecular Formula
C24H32F12FeN6Sb2;
Canonical SMILES
CC#N.CC#N.C1CC(N(C1)CC2=CC=CC=N2)C3CCCN3CC4=CC=CC=N4.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F.[Fe+2];
InChI
InChI=1S/C20H26N4.2C2H3N.12FH.Fe.2Sb/c1-3-11-21-17(7-1)15-23-13-5-9-19(23)20-10-6-14-24(20)16-18-8-2-4-12-22-18;2*1-2-3;;;;;;;;;;;;;;;/h1-4,7-8,11-12,19-20H,5-6,9-10,13-16H2;2*1H3;12*1H;;;/q;;;;;;;;;;;;;;;+2;2*+5/p-12/t19-,20-;;;;;;;;;;;;;;;;;/m1................./s1;
InChI Key
XUNWHBGEOCZDBX-QSKJABRXSA-B;
Complexity
444
Covalently-Bonded Unit Count
6
Defined Atom Stereocenter Count
2
Exact Mass
931.993g/mol
H-Bond Acceptor
20
Heavy Atom Count
45
Monoisotopic Mass
929.992g/mol
Rotatable Bond Count
5
Topological Polar Surface Area
79.8A^2
Application
The purpose of 2S,2'S-(-)-[N,N'-Bis(2-pyridylmethyl)]-2,2'-bipyrrolidinebis(acetonitrile)iron(II) hexafluoroantimonate is to serve as a metal complex in the iron-catalyzed, selective oxidation of C-H bonds. This compound is designed to facilitate precise and efficient oxidation reactions, providing a valuable tool for chemical transformations that require selective targeting of C-H bonds.
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