J. Mazurek et al., ORTHORHOMBIC AND TRICLINIC FORMS OF -N-P-TOLYL-4-P-TOLYL-AMINO-6-PYRIMIDINECARBOXAMIDE AND )-N-P-TOLYL-4-P-TOLYLAMINO-6-PYRIMIDINECARBOXAMIDE, Acta crystallographica. Section C, Crystal structure communications, 52, 1996, pp. 2106-2111
2-Chloro-5-p -N-p-tolyl-4-p-tolylamino-6-pyrimidinecarboxamide, C27H24
ClN5O2, crystallizes in two forms: orthorhombic (I) and triclinic (Ia)
, The orthorhombic form is almost isomorphous with the crystals of N-p
-tolyl-5-benzoylamino-2-chloro-4-p-tolylamino -6-pyrimidinecarboxyamid
e. The triclinic form is almost isomorphous with the crystals of 2-chl
oro-5-(p- chlorobenzoylamino)-N-p-tolyl-4 -p-tolylamino-6-pyrimidineca
rboxamide, C26H21Cl2N5O2 (II). The molecules of (I), (Ia) and (II) are
almost planar but are slightly bowed: the near-planarity is due to th
e intramolecular hydrogen bonds which are almost identical in all thes
e structures, with N-H amide groups participating ire intramolecular h
ydrogen bonds as donors, while each carbonyl O atom and one pyrimidine
N atom are accepters, In crystals of (I) the molecules are arranged i
n polymeric chains running along the a axis. In crystals of (Ia) and (
II) the molecules are arranged in dimers Linked across crystallographi
c inversion centres by weak intermolecular hydrogen bonds.