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. 2021 Nov 12;77(Pt 6):892–905. doi: 10.1107/S2052520621009379

Table 2. Integrated number of electrons (N e) and real space R value (R RS) of ibuprofen and sila-ibuprofen over interaction density grids, visualized in Fig. 5 .

  Ibuprofen Sila-ibuprofen
Model N e (e) R RS (%) N e (e) R RS (%)
S 0.402 0.358 0.424 0.353
C 0.527 0.470 0.476 0.397
P 0.508 0.453 0.416 0.384