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By reaction of [B 6 H 6 ] 2- with (SCN) 2  in dichloromethane at -80 C° the thiocyanatohexaborate anion is formed and can be isolated by ion exchange chromatography on diethylaminoethyl (DEAE) cellulose. The X-ray structure determination of Cs 2 [B 6 H 5 (SCN)] (orthorhombic, space group Pbca with a = 9.506(5), b = 10.644(5), c = 21.857(5) Å, Z = 8) reveals that the SCN substituent is bonded via the S atom with the B-S distance of 1.885(9) Å and the B-S-C angle of 99.8(5)°. The SCN group is nearly linear (179.9(9)°).

Kristallstruktur von Cs 2 [B 6 H 5 (SCN)]/ Crystal Structure of Cs 2 [B 6 H 5 (SCN)]