caa a22 4500 463184475 CHVBK 20180406164848.0 cr unu---uuuuu 170326e20070301xx s 000 0 eng 10.1007/s10870-006-9171-8 doi (NATIONALLICENCE)springer-10.1007/s10870-006-9171-8 The crystal and molecular structure of a trifluoroacetylacetonate complex of scandium, Sc(CH3COCHCOCF3)3 [Elektronische Daten] [Dennis Bennett, Tasneem Siddiquee, Daniel Haworth, Sergey Lindeman] The crystal and molecular structure of Sc(CH3COCHCOCF3)3 has been determined by X-ray diffraction. The compound crystallizes as pure mer-isomer in the orthorhombic space group Pbca with lattice parameters a=15.166(8) Å, b=13.560(7) Å, c=19.327(10) Å, α=β=γ=90°, V=3974(4) Å3, Z=8. The complex at 100K is partially disordered in the crystal structure in an approximate 5:1 ratio with 83% fluorine population at C-11 and 17% at C-15. NMR data is compared to that previously reported. Springer Science+Business Media, LLC, 2007 trifluoroacetylactonate nationallicence scandium acac nationallicence dipole moment nationallicence Bennett Dennis Department of Chemistry, University of Wisconsin - Milwaukee, P.O. Box 413, 53201-0413, Milwaukee, Wisconsin, USA aut Siddiquee Tasneem Department of Chemistry, University of Wisconsin - Milwaukee, P.O. Box 413, 53201-0413, Milwaukee, Wisconsin, USA aut Haworth Daniel Department of Chemistry, Marquette University, P.O. Box 1881, 53201-1881, Milwaukee, Wisconsin aut Lindeman Sergey Department of Chemistry, Marquette University, P.O. Box 1881, 53201-1881, Milwaukee, Wisconsin aut Journal of Chemical Crystallography Kluwer Academic Publishers-Plenum Publishers; http://www.springer-ny.com 37/3(2007-03-01), 207-212 1074-1542 37:3<207 2007 37 10870 https://doi.org/10.1007/s10870-006-9171-8 text/html Onlinezugriff via DOI 1 brief-communication jats NATIONALLICENCE 856 40 https://doi.org/10.1007/s10870-006-9171-8 text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Bennett Dennis Department of Chemistry, University of Wisconsin - Milwaukee, P.O. Box 413, 53201-0413, Milwaukee, Wisconsin, USA aut NATIONALLICENCE 700 1- Siddiquee Tasneem Department of Chemistry, University of Wisconsin - Milwaukee, P.O. Box 413, 53201-0413, Milwaukee, Wisconsin, USA aut NATIONALLICENCE 700 1- Haworth Daniel Department of Chemistry, Marquette University, P.O. Box 1881, 53201-1881, Milwaukee, Wisconsin aut NATIONALLICENCE 700 1- Lindeman Sergey Department of Chemistry, Marquette University, P.O. Box 1881, 53201-1881, Milwaukee, Wisconsin aut NATIONALLICENCE 773 0- Journal of Chemical Crystallography Kluwer Academic Publishers-Plenum Publishers; http://www.springer-ny.com 37/3(2007-03-01), 207-212 1074-1542 37:3<207 2007 37 10870 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer