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. 2016 Mar 30;3(Pt 3):192–199. doi: 10.1107/S2052252516002815

Table 2. Summary of experimental Raman shifts in the co-crystal compared with pure substances, from work by Vu et al. (2014).

At 80 K, the crystal structure of ethane is assumed to have been the monoclinic phase of ethane, as described by van Nes & Vos (1978), rather than the plastic cubic phase that exists at ∼ 90 K

  ν1(a 1g) CH3 sym stretch (cm−1) ν11(eg) CH3 deform. stretch (cm−1) ν1(a 1g) CH sym stretch (cm−1) ν7(e 2g) CH asym stretch (cm−1) ν7(e 2g) CH asym stretch (cm−1)
Benzene in co-crystal at 90 K 3063.6 3040.6 3047.1
Solid benzene at 90 K 3063.3 3043.7 3048.9
Ethane in co-crystal at 90 K 2872.6 1454.8
Solid (monoclinic) ethane at 80 K 2877.0 1461.5
Liquid ethane at 90 K 2884.8 1467.1