Skip to main content
. 2010 Oct 20;132(44):15462–15464. doi: 10.1021/ja107703n

Table 1. Selected X-ray Crystallographic and Calculated Structural Parameters for 2, 4, 22, and 23.

  2
4 22 23
  X-ray Calcd Calcd Calcd Calcd
d(Ni−C), Å 1.900(7) 1.930 1.962 1.963 1.933
  1.930 1.962 1.962 1.957
  1.930 1.962 1.963 1.957
  1.930 1.963 1.963 1.932
∠C−Ni−C, deg
(cis)
90 90.01 91.96 90.29 87.50
90 90.00 92.00 90.40 92.79
90 90.02 91.95 90.34 87.50
90 89.96 91.97 90.33 87.10
∠C−Ni−C, deg
(trans)
180 179.77 158.57 171.16 178.01
180 179.82 158.67 171.16 176.86
d(Ccarbene−N), Å 1.331(6) 1.366 1.391 1.377 1.370
    1.366 1.404 1.381 1.370
∠N−Ccarbene−N, deg 102.6(6) 104.2 101.5 103.0 104.7