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. Author manuscript; available in PMC: 2009 Sep 30.
Published in final edited form as: Dalton Trans. 2008 Dec 5;(3):424–433. doi: 10.1039/b810895a

Table 2.

Comparison of 13C NMR chemical shifts for NOCbl, NO2Cbl and NH3Cbl37a

Group δ NOCbl δ NO2Cbl (Δδ) δNH3Cbl (Δδ)
C54 20.34 18.31 (2.03) 19.16 (1.18)
C20 24.48 22.45 (2.00) 22.73 (1.75)
C49 36.04 37.33 (−1.29) 37.36 (−1.32)
C60 37.86 34.05 (3.81) 34.01 (3.85)
C37 46.51 44.80 (1.71) 48.09 (−1.58)
R2 72.91 71.29 (1.62) 71.28 (1.63)
R1 88.51 89.64 (−1.13) 89.77 (−1.26)
C15 107.60 106.05 (1.55) 106.41 (1.19)
B4 121.29 119.07 (2.22) 118.81 (2.48)
B5 133.99 135.64 (−1.65) 135.88 (−1.89)
B8 134.21 132.05 (2.16) 132.09 (2.12)
B6 135.75 137.80 (−2.05) 138.07 (−2.32)
B9 142.20 139.17 (3.03) 139.11 (3.09)
C14 166.30 167.96 (−1.66) 168.23 (−1.93)
C9 174.53 175.89 (−1.36) 177.01 (−2.48)
C16 178.23 180.73 (−2.50) 182.50 (−4.27)
C4 178.71 182.47 (−3.76) 183.73 (−5.02)
C32 178.71 180.44 (−1.73) 180.42 (−1.71)
C61 180.73 178.23 (2.50) 177.63 (3.10)
a

Only chemical shifts which differ by ≥1.00 ppm from those for NOCbl are shown.