1,2-Naphthalenedicarboxylic acid: structures of channel clathrates and an unsolvated crystalline phase

(1) 1,2-Naphthalenedicarboxylic acid-diethyl ether, C12H8O4.nC4H10O, M(r) = 216.19, tetragonal, I4(1)/a, a = 22.086 (3), c = 9.463 (3) A, V = 4616 (2) A3, Z = 16, F(000) = 1792 (without ether), F(000) = 1873 (with 2.7 molecules of ether per unit cell), Dx = 1.24 g cm-3 (without ether), Dx = 1.31 g cm-3 (with 2.7 molecules of ether per unit cell), lambda(Mo K alpha) = 0.71073 A, T = 296 K, mu = 0.88 cm-1, R = 0.052 for 1130 unique reflections having I greater than 3 sigma I. (2) 1,2-Naphthalenedicarboxylic acid, C12H8O4, M(r) = 216.19, triclinic, P1, a = 9.027 (1), b = 9.234 (1), c = 7.256 (1) A, alpha = 106.08 (1), beta = 90.79 (1), gamma = 111.80 (1) degrees, V = 535.0 (1) A3, Z = 2, F(000) = 224, Dx = 1.34 g cm-3, lambda (Mo K alpha) = 0.71073 A, T = 296 K, mu = 0.95 cm-1, R = 0.043 for 1216 unique reflections having I greater than 3 sigma I. (3) 1,2-Naphthalenedicarboxylic acid-dimethoxyethane, C12H8O4.nC4H10O2, M(r) = 216.19, tetragonal, I4(1)/a, a = 22.067 (2), c = 9.465 (2) A, V = 4609 (1) A3, Z = 16, Dx = 1.25 g cm-3 (without dimethoxyethane), Dx = 1.39 g cm-3 (with 4.4 molecules of dimethoxyethane per unit cell), lambda(Mo K alpha) = 0.71073 A, T = 296 K.(ABSTRACT TRUNCATED AT 250 WORDS)