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C 21 H 33 Cl 9 Fe 2 N 12 O 9 , trigonal,R3   ‾$R\overline{3}$(no. 148),  a  = 13.1897(3) Å,  c  = 39.5222(9) Å,  Z  = 6,  V  = 5954.4(3) Å 3 ,  Rgt   ( F ) = 0.0255,  wRref   ( F   2 ) = 0.0743, T = 120 K.

zeitschrift für kristallographie - new crystal structures

Cones with a three-fold symmetry constructed from three hydrogen bonded theophyllinium cations that coat [FeCl 4 ] −  anions in the crystal structure of tris(theophyllinium) bis(tetrachloridoferrate(III)) chloride trihydrate, C 21 H 33 Cl 9 Fe 2 N 12 O 9