Tm. Gilbert et Rd. Rogers, STRUCTURES OF Z-(NITROSTILBENE)CHROMIUM TRICARBONYL COMPLEXES - THE EFFECT OF METAL COORDINATION ON THE NONPLANARITY OF THE STILBENE SYSTEM, Journal of chemical crystallography, 24(5), 1994, pp. 315-320
The structures of the nitrostilbene complexes Z-(4-R-C6H4-CH=CH-C6H4-4
'-NO2)Cr(CO)3 (R = Me2N, 1; H, 2; F3C, 3), are reported. The compounds
were prepared as part of a study of the synthesis of organometallic c
omplexes with potential nonlinear optics applications. For Z-(4-Me2N-C
6H4-CH=CH-C6H4-4'-NO2)Cr(CO)3, 1, triclinic, P1BAR, a = 7.214 (3) angs
trom, b = 7.340 (3) angstrom, c = 17.238 (9) angstrom, alpha = 88.23 (
5)-degrees, beta = 88.76 (4)-degrees, gamma = 87.66 (3)-degrees, Z = 2
. For Z-(C6H5-CH=CH-C6H4-4'-NO2)Cr(CO)3, 2, monoclinic, P2(1)/c, a = 1
2.255 (3) angstrom, b = 9.415 (1) angstrom, c = 13.579 (4) angstrom, b
eta = 105.60 (2)-degrees, Z = 4. For Z-(4-F3C-C6H4-CH=CH-C6H4-4'-NO2)C
r(CO)3, 3, triclinic, P1BAR, a = 7.094 (2) angstrom, b = 8.057 (5) ang
strom, c = 17.295 (9) angstrom, alpha = 87.95 (5)-degrees, beta = 85.9
4 (4)-degrees, gamma = 64.24 (5)-degrees, Z = 2. The structural data s
how that the Z isomers exhibit bond lengths and angles similar to thos
e observed in the E isomers, but the stilbene fragment is considerably
more nonplanar. As a consequence, these molecules are unlikely to beh
ave as NLO materials.