Synonyms
2-[[(2R)-2-[(2R)-1-(Pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]pyridine
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
931.9
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;
Purity
98%
Appearance
Purple powder
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
