CRYSTAL ENGINEERING USING TRIS-PHENOLS - CROSS-LINKED, PAIRWISE-INTERWOVEN 2-DIMENSIONAL NETS IN THE 2 1 ADDUCT OF 1,1,1-TRIS(4-HYDROXYPHENYL)ETHANE WITH 1,2-DIAMINOETHANE/
G. Ferguson et al., CRYSTAL ENGINEERING USING TRIS-PHENOLS - CROSS-LINKED, PAIRWISE-INTERWOVEN 2-DIMENSIONAL NETS IN THE 2 1 ADDUCT OF 1,1,1-TRIS(4-HYDROXYPHENYL)ETHANE WITH 1,2-DIAMINOETHANE/, Acta crystallographica. Section B, Structural science, 54, 1998, pp. 330-338
In 1,1,1-tris(4-hydroxyphenyl)ethane-1, 2-diaminoethane (2/1), [CH3C(C
6H4OH)(3)](2).H2NCH2CH2NH2 (1), triclinic, P (1) over bar, with Z = 2,
a = 10.9430(12), b = 11.1075(12), c = 15.249(2) Angstrom, alpha = 98.
672(15), beta = 96.312(10), gamma = 98.377(13)degrees, the tris-phenol
units form continuous two-dimensional nets, built from pseudohexagona
l R-4(4)(38) rings, interwoven pairs of which are cross-linked by the
Id-diaminoethane units. Each tris-phenol unit acts as a triple donor,
forming two O-H...O and one O-H...N hydrogen bonds, and as a double ac
ceptor in two O-H...O hydrogen bonds: the diamine unit, in which the C
H2 groups are disordered over two sets of sites with site-occupation f
actors of 0.740(5) and 0.260(5), respectively, acts as a double accept
or only and the N-H bonds play no role in the hydrogen bonding. The O.
..O distances in the O-H...O hydrogen bonds are 2.642(2), 2.690(2), 2.
810(2) and 2.835(2) Angstrom, and the two independent 0 N distances ar
e both 2.665 (3) Angstrom. Adjacent bilayers are connected into a cont
inuous three-dimensional array by C--H O hydrogen bonds, all having a
C...O distance of 3.468 (4) Angstrom.