A preliminary model for the crystal structure of form III of isotactic
poly(4-methylpentene-1) is suggested on the basis of structure factor
calculations. Chains in 4(1) helical conformations are packed in a te
tragonal unit cell with axes a = 19.38 angstrom and c = 6.98 angstrom;
the space group is I4(1). The polymorphic behavior of poly(4-methylpe
ntene-1) is discussed on the basis of conformational energy calculatio
ns on the isolated chain. The presence of different modifications is i
n accordance with energy minima present in the conformational energy m
ap.