X-ray diffraction data were collected at 20°C on a computer-controlled Philips diffractometer (PW 1100). The structure was solved by direct methods and refined by the full-matrix least-squares method to an R of 0.065 (weighted R 0.046). The molecule in the crystal is of lower symmetry than C2,.. The geometry of the molecule has been compared with NMR results obtained by Danieli, Lunazzi & Veracini [J. Chem. Soc. Perkin II, (1976), pp. 19-201. As a result a C-H bond-length correction of 0.09 (2) A was found.
|Journal||Acta Crystallographica Section B: Structural crystallography and crystal chemistry|
|Publication status||Published - 1977|
Huiszoon, C., van Hummel, G. J., & van den Ham, D. M. W. (1977). The crystal and molecular structure of 2,7-diazanaphthalene. Acta Crystallographica Section B: Structural crystallography and crystal chemistry, 33, 1867-1870. https://doi.org/10.1107/S0567740877007225