C. George et al., 3,7-DINITRONORADAMANTANE, C9H12N2O4, AND 3,7,9-TRINITRONORADAMANTANE,C9H11N3O(6), Acta crystallographica. Section C, Crystal structure communications, 51, 1995, pp. 703-706
The possible C-2v molecular symmetry for the dinitronoradamantane comp
ound is not present; however, the carbon cages in each of the title co
mpounds [3a,6a-dinitrooctahydro-2,5-methanopentalene and 3a,6a,7-trini
trooctahydro-2,5-methanopentalene, respectively] have approximate C-2v
symmetry. Although the C-C-N-O torsion angles of the nitro groups dif
fer significantly from the 90 degrees required for C-2v molecular symm
etry, approximate C-2 symmetry is maintained for both molecules in the
asymmetric unit, Bond distances and angles are near expected values w
ith the exception of the C3-C7 bond distance in both title compounds w
hich averages 1.594(4) Angstrom.