metal-organic compounds
Potassium bis(1,1,1,5,5,5-hexafluoropentane-2,4-dionato)bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionato)europate(III)
aDepartment of Chemistry and Biochemistry, The University of Texas at Austin, 1 University Station, A5300, Austin, Texas 78712, USA
*Correspondence e-mail: bholliday@cm.utexas.edu
In the 5HF6O2)2(C10H6F3O2)2], the EuIII ion is in a slightly distorted square-antiprismatic coordination geometry which is defined by eight O atoms of the anionic β-diketone ligands. The two K+ ions lie on crystallographic inversion centers. The Eu—O bond distances are in the range 2.294 (5)–2.413 (5) Å. The crystal used was a non-merohedral twin, the ratio of the twin domains being 0.5236 (5):0.4764 (5).
of the title complex, K[Eu(CRelated literature
For general background to and potential applications of luminescent lanthanide complexes containing β-diketonates, see: Eliseeva & Bunzli (2010); de Bettencourt-Dias (1997); Stanley et al. (2010); Chen & Holliday (2008). For similar structures, see: Nockemann et al. (2005); Burns & Danford (1969). The was determined using TwinSolve (Rigaku/MSC, 2002).
Experimental
Crystal data
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Refinement
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Data collection: CrystalClear (Rigaku/MSC, 2008); cell CrystalClear; data reduction: CrystalClear; program(s) used to solve structure: SIR97 (Altomare et al., 1999) within WinGX (Farrugia, 1999); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: ORTEP-3 (Farrugia, 1997) and POV-RAY (Persistence of Vision, 2004); software used to prepare material for publication: SHELXL97.
Supporting information
10.1107/S1600536810021458/lh5047sup1.cif
contains datablocks I, global. DOI:Structure factors: contains datablock I. DOI: 10.1107/S1600536810021458/lh5047Isup2.hkl
The title compound, K[Eu(hfac)2(btfac)2], was obtained as an unexpected product during the attempted synthesis of a europium tris(β-diketonate) bis(pyrazolyl)pyridine complex in which potassium tert-butoxide was used to deprotonate the β-diketone prior to complexation with the lanthanide salt.
The data crystal was twinned, which can result in more than one entry in the reflection file for a given set of h,k,l indices.
can lead to more reflections being used in the than the actual number of unique reflections. The was determined using TwinSolve (Rigaku/MSC, 2002). The twin resulted from a 180 degree rotation about the 0-10 direction with twin matrix [-1.000, -0.470, 0.000; -0.001, 1.000, 0.000; 0.000, -0.540, -0.999]. The twin fraction refined to 0.4764 (5).All H atoms were positioned geometrically and refined using a riding model, with C—H = 0.95 Å and with Uiso(H) = 1.2 (1.5 for methyl groups) times Ueq(C).
Data collection: CrystalClear (Rigaku/MSC, 2008); cell
CrystalClear (Rigaku/MSC, 2008); data reduction: CrystalClear (Rigaku/MSC, 2008); program(s) used to solve structure: SIR97 (Altomare et al., 1999) within WinGX (Farrugia, 1999); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: ORTEP-3 (Farrugia, 1997) and POV-RAY (Persistence of Vision, 2004); software used to prepare material for publication: SHELXL97 (Sheldrick, 2008).K[Eu(C5HF6O2)2(C10H6F3O2)2] | Z = 2 |
Mr = 1035.47 | F(000) = 1004 |
Triclinic, P1 | Dx = 1.980 Mg m−3 |
Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71069 Å |
a = 11.737 (2) Å | Cell parameters from 30786 reflections |
b = 12.468 (2) Å | θ = 4.7–27.5° |
c = 13.788 (3) Å | µ = 2.07 mm−1 |
α = 68.457 (8)° | T = 100 K |
β = 71.791 (8)° | Block, colourless |
γ = 71.726 (8)° | 0.12 × 0.06 × 0.03 mm |
V = 1737.1 (5) Å3 |
Rigaku AFC12 with Saturn 724+ CCD diffractometer | 25336 independent reflections |
Radiation source: fine-focus sealed tube | 22905 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.000 |
ω–scans | θmax = 25.0°, θmin = 4.7° |
Absorption correction: multi-scan (ABSCOR; Higashi, 2001) | h = −13→13 |
Tmin = 0.789, Tmax = 0.941 | k = −14→14 |
25336 measured reflections | l = −16→16 |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.096 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.197 | H-atom parameters constrained |
S = 3.00 | w = 1/[σ2(Fo2) + (0.040P)2] where P = (Fo2 + 2Fc2)/3 |
25336 reflections | (Δ/σ)max = 0.008 |
527 parameters | Δρmax = 3.65 e Å−3 |
0 restraints | Δρmin = −3.79 e Å−3 |
K[Eu(C5HF6O2)2(C10H6F3O2)2] | γ = 71.726 (8)° |
Mr = 1035.47 | V = 1737.1 (5) Å3 |
Triclinic, P1 | Z = 2 |
a = 11.737 (2) Å | Mo Kα radiation |
b = 12.468 (2) Å | µ = 2.07 mm−1 |
c = 13.788 (3) Å | T = 100 K |
α = 68.457 (8)° | 0.12 × 0.06 × 0.03 mm |
β = 71.791 (8)° |
Rigaku AFC12 with Saturn 724+ CCD diffractometer | 25336 independent reflections |
Absorption correction: multi-scan (ABSCOR; Higashi, 2001) | 22905 reflections with I > 2σ(I) |
Tmin = 0.789, Tmax = 0.941 | Rint = 0.000 |
25336 measured reflections |
R[F2 > 2σ(F2)] = 0.096 | 0 restraints |
wR(F2) = 0.197 | H-atom parameters constrained |
S = 3.00 | Δρmax = 3.65 e Å−3 |
25336 reflections | Δρmin = −3.79 e Å−3 |
527 parameters |
Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. |
Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. |
x | y | z | Uiso*/Ueq | ||
C1 | 0.1917 (8) | 0.5647 (8) | −0.0670 (7) | 0.046 (2) | |
C2 | 0.1678 (6) | 0.5603 (6) | 0.0491 (5) | 0.0270 (16) | |
C3 | 0.0581 (7) | 0.6211 (6) | 0.0938 (6) | 0.0309 (17) | |
H3 | 0.0018 | 0.6697 | 0.0497 | 0.037* | |
C4 | 0.0261 (6) | 0.6153 (6) | 0.1978 (6) | 0.0258 (16) | |
C5 | −0.0953 (7) | 0.6967 (7) | 0.2354 (6) | 0.0380 (19) | |
C6 | 0.6359 (8) | 0.1771 (7) | 0.1235 (6) | 0.041 (2) | |
C7 | 0.5469 (7) | 0.2239 (6) | 0.2119 (6) | 0.0338 (17) | |
C8 | 0.5666 (7) | 0.1706 (7) | 0.3098 (7) | 0.039 (2) | |
H8 | 0.6384 | 0.1092 | 0.3191 | 0.047* | |
C9 | 0.4860 (6) | 0.2006 (6) | 0.4008 (6) | 0.0296 (17) | |
C10 | 0.5163 (8) | 0.1435 (6) | 0.5104 (6) | 0.0381 (19) | |
C11 | 0.4273 (8) | 0.1526 (9) | 0.5946 (6) | 0.066 (3) | |
H25 | 0.3452 | 0.1863 | 0.5858 | 0.079* | |
C12 | 0.4490 (10) | 0.1155 (9) | 0.6927 (8) | 0.065 (3) | |
H26 | 0.3856 | 0.1315 | 0.7517 | 0.078* | |
C13 | 0.5696 (10) | 0.0513 (9) | 0.7066 (8) | 0.058 (3) | |
H27 | 0.5886 | 0.0198 | 0.7752 | 0.070* | |
C14 | 0.6554 (8) | 0.0375 (9) | 0.6180 (8) | 0.057 (3) | |
H28 | 0.7372 | −0.0031 | 0.6249 | 0.069* | |
C15 | 0.6304 (9) | 0.0789 (9) | 0.5191 (7) | 0.063 (3) | |
H29 | 0.6909 | 0.0628 | 0.4587 | 0.076* | |
C16 | 0.0084 (8) | 0.1836 (7) | 0.5500 (6) | 0.041 (2) | |
C17 | 0.0708 (7) | 0.2337 (6) | 0.4328 (6) | 0.0319 (18) | |
C18 | 0.0681 (9) | 0.1848 (8) | 0.3593 (7) | 0.050 (3) | |
H15 | 0.0174 | 0.1301 | 0.3809 | 0.059* | |
C19 | 0.1342 (8) | 0.2112 (6) | 0.2585 (7) | 0.040 (2) | |
C20 | 0.1338 (7) | 0.1522 (6) | 0.1815 (6) | 0.0357 (18) | |
C21 | 0.2254 (11) | 0.1550 (9) | 0.0945 (7) | 0.079 (4) | |
H16 | 0.2851 | 0.1988 | 0.0802 | 0.095* | |
C22 | 0.2341 (10) | 0.0944 (8) | 0.0250 (8) | 0.066 (3) | |
H17 | 0.3015 | 0.0934 | −0.0349 | 0.079* | |
C23 | 0.1444 (12) | 0.0361 (9) | 0.0438 (9) | 0.076 (4) | |
H18 | 0.1508 | −0.0062 | −0.0034 | 0.091* | |
C24 | 0.0410 (10) | 0.0374 (8) | 0.1331 (8) | 0.068 (3) | |
H19 | −0.0242 | 0.0011 | 0.1450 | 0.081* | |
C25 | 0.0430 (9) | 0.0959 (8) | 0.2015 (7) | 0.049 (2) | |
H20 | −0.0211 | 0.0963 | 0.2639 | 0.059* | |
C26 | 0.2817 (8) | 0.5623 (8) | 0.5313 (7) | 0.045 (2) | |
C27 | 0.3058 (7) | 0.5583 (6) | 0.4158 (6) | 0.0352 (18) | |
C28 | 0.3889 (6) | 0.6178 (6) | 0.3388 (6) | 0.0266 (16) | |
H22 | 0.4258 | 0.6631 | 0.3574 | 0.032* | |
C29 | 0.4211 (6) | 0.6142 (6) | 0.2347 (6) | 0.0283 (16) | |
C30 | 0.5014 (7) | 0.6967 (7) | 0.1520 (6) | 0.0388 (19) | |
Eu1 | 0.27159 (3) | 0.40232 (3) | 0.27527 (3) | 0.02047 (10) | |
F1 | 0.3069 (4) | 0.5677 (4) | −0.1188 (3) | 0.0435 (11) | |
F2 | 0.1728 (5) | 0.4659 (5) | −0.0700 (4) | 0.0657 (17) | |
F3 | 0.1194 (5) | 0.6532 (6) | −0.1202 (4) | 0.088 (2) | |
F4 | −0.1848 (4) | 0.6928 (5) | 0.2024 (4) | 0.0598 (14) | |
F5 | −0.0824 (5) | 0.8077 (4) | 0.2013 (4) | 0.0570 (15) | |
F6 | −0.1285 (4) | 0.6694 (4) | 0.3418 (3) | 0.0407 (11) | |
F7 | 0.6624 (4) | 0.2662 (3) | 0.0350 (3) | 0.0412 (11) | |
F8 | 0.7376 (5) | 0.1090 (5) | 0.1463 (4) | 0.0737 (17) | |
F9 | 0.5835 (5) | 0.1168 (4) | 0.0933 (4) | 0.0519 (13) | |
F10 | 0.0912 (5) | 0.1121 (3) | 0.6036 (4) | 0.0563 (14) | |
F11 | −0.0526 (4) | 0.2664 (3) | 0.5961 (3) | 0.0385 (10) | |
F12 | −0.0690 (5) | 0.1203 (4) | 0.5625 (4) | 0.0638 (15) | |
F13 | 0.5488 (4) | 0.6708 (4) | 0.0626 (3) | 0.0395 (10) | |
F14 | 0.4382 (5) | 0.8067 (4) | 0.1321 (4) | 0.0584 (16) | |
F15 | 0.5956 (5) | 0.6911 (5) | 0.1884 (4) | 0.0709 (16) | |
F16 | 0.1628 (4) | 0.5698 (4) | 0.5792 (3) | 0.0427 (11) | |
F17 | 0.3433 (5) | 0.4672 (5) | 0.5884 (4) | 0.0657 (17) | |
F18 | 0.3105 (6) | 0.6547 (5) | 0.5334 (4) | 0.0800 (19) | |
O1 | 0.2551 (4) | 0.4986 (5) | 0.0915 (4) | 0.0251 (12) | |
O2 | 0.0837 (4) | 0.5516 (4) | 0.2704 (4) | 0.0269 (11) | |
O3 | 0.4609 (4) | 0.3098 (4) | 0.1823 (4) | 0.0312 (11) | |
O4 | 0.3868 (4) | 0.2735 (4) | 0.3960 (4) | 0.0358 (12) | |
O5 | 0.1244 (4) | 0.3130 (4) | 0.4191 (3) | 0.0291 (11) | |
O6 | 0.2076 (5) | 0.2811 (4) | 0.2196 (4) | 0.0368 (12) | |
O7 | 0.3927 (4) | 0.5503 (4) | 0.1993 (4) | 0.0273 (11) | |
O8 | 0.2463 (4) | 0.4963 (5) | 0.4063 (4) | 0.0302 (13) | |
K1 | 0.0000 | 0.5000 | 0.5000 | 0.0293 (6) | |
K2 | 0.5000 | 0.5000 | 0.0000 | 0.0270 (6) |
U11 | U22 | U33 | U12 | U13 | U23 | |
C1 | 0.042 (5) | 0.060 (6) | 0.039 (5) | 0.001 (4) | −0.019 (4) | −0.020 (4) |
C2 | 0.023 (4) | 0.037 (4) | 0.021 (4) | −0.013 (3) | −0.003 (3) | −0.007 (3) |
C3 | 0.031 (4) | 0.033 (4) | 0.022 (4) | −0.006 (3) | −0.003 (3) | −0.003 (3) |
C4 | 0.018 (4) | 0.018 (3) | 0.035 (4) | 0.003 (3) | −0.005 (3) | −0.008 (3) |
C5 | 0.037 (5) | 0.050 (5) | 0.027 (4) | −0.004 (4) | −0.013 (4) | −0.012 (4) |
C6 | 0.044 (5) | 0.040 (5) | 0.029 (4) | 0.002 (4) | 0.001 (4) | −0.014 (4) |
C7 | 0.029 (4) | 0.028 (4) | 0.041 (5) | −0.002 (3) | −0.002 (4) | −0.015 (3) |
C8 | 0.026 (4) | 0.030 (4) | 0.049 (5) | 0.005 (3) | 0.000 (4) | −0.013 (4) |
C9 | 0.026 (4) | 0.033 (4) | 0.025 (4) | −0.009 (3) | 0.002 (3) | −0.007 (3) |
C10 | 0.051 (5) | 0.023 (4) | 0.034 (4) | −0.004 (3) | −0.010 (4) | −0.003 (3) |
C11 | 0.037 (5) | 0.099 (8) | 0.025 (5) | 0.013 (5) | −0.010 (4) | 0.001 (5) |
C12 | 0.064 (7) | 0.074 (7) | 0.051 (6) | 0.007 (5) | −0.020 (5) | −0.026 (5) |
C13 | 0.060 (7) | 0.075 (7) | 0.053 (6) | −0.007 (5) | −0.030 (6) | −0.026 (5) |
C14 | 0.030 (5) | 0.076 (7) | 0.058 (6) | −0.015 (4) | −0.018 (5) | −0.001 (5) |
C15 | 0.046 (6) | 0.071 (7) | 0.024 (5) | 0.032 (5) | −0.008 (4) | 0.001 (4) |
C16 | 0.057 (5) | 0.027 (4) | 0.032 (4) | −0.020 (4) | 0.003 (4) | −0.001 (3) |
C17 | 0.034 (4) | 0.017 (4) | 0.033 (4) | −0.009 (3) | 0.011 (3) | −0.007 (3) |
C18 | 0.064 (6) | 0.047 (6) | 0.049 (6) | −0.033 (5) | 0.014 (5) | −0.031 (4) |
C19 | 0.058 (5) | 0.032 (4) | 0.039 (5) | −0.023 (4) | −0.015 (4) | −0.009 (4) |
C20 | 0.048 (5) | 0.034 (4) | 0.029 (4) | −0.025 (4) | 0.001 (4) | −0.007 (3) |
C21 | 0.141 (10) | 0.098 (8) | 0.032 (5) | −0.096 (8) | 0.022 (6) | −0.034 (5) |
C22 | 0.080 (7) | 0.041 (5) | 0.072 (7) | −0.021 (5) | 0.010 (6) | −0.028 (5) |
C23 | 0.104 (9) | 0.052 (6) | 0.068 (7) | −0.019 (6) | 0.005 (7) | −0.032 (6) |
C24 | 0.088 (8) | 0.052 (6) | 0.059 (7) | −0.035 (5) | 0.002 (6) | −0.010 (5) |
C25 | 0.070 (6) | 0.060 (6) | 0.033 (5) | −0.044 (5) | 0.001 (4) | −0.018 (4) |
C26 | 0.050 (6) | 0.058 (6) | 0.040 (5) | −0.017 (5) | −0.011 (5) | −0.023 (4) |
C27 | 0.030 (4) | 0.030 (4) | 0.055 (5) | 0.004 (3) | −0.018 (4) | −0.025 (4) |
C28 | 0.017 (4) | 0.028 (4) | 0.045 (5) | −0.011 (3) | −0.014 (3) | −0.012 (3) |
C29 | 0.026 (4) | 0.031 (4) | 0.031 (4) | −0.003 (3) | −0.014 (3) | −0.009 (3) |
C30 | 0.041 (5) | 0.047 (5) | 0.040 (5) | −0.029 (4) | −0.008 (4) | −0.009 (4) |
Eu1 | 0.01748 (16) | 0.02274 (16) | 0.02001 (16) | −0.00665 (12) | 0.00050 (11) | −0.00718 (13) |
F1 | 0.047 (3) | 0.057 (3) | 0.027 (2) | −0.017 (2) | −0.004 (2) | −0.013 (2) |
F2 | 0.067 (4) | 0.100 (6) | 0.058 (4) | −0.045 (3) | 0.001 (3) | −0.046 (3) |
F3 | 0.066 (4) | 0.129 (5) | 0.034 (3) | 0.036 (4) | −0.023 (3) | −0.024 (3) |
F4 | 0.028 (3) | 0.092 (4) | 0.074 (4) | 0.013 (2) | −0.025 (3) | −0.052 (3) |
F5 | 0.077 (4) | 0.025 (3) | 0.053 (3) | −0.002 (2) | −0.005 (3) | −0.008 (2) |
F6 | 0.027 (2) | 0.041 (2) | 0.044 (3) | 0.0052 (18) | −0.001 (2) | −0.018 (2) |
F7 | 0.037 (3) | 0.036 (2) | 0.039 (3) | −0.0106 (19) | 0.012 (2) | −0.014 (2) |
F8 | 0.054 (3) | 0.080 (4) | 0.051 (3) | 0.039 (3) | −0.011 (3) | −0.025 (3) |
F9 | 0.069 (3) | 0.037 (2) | 0.045 (3) | −0.013 (2) | 0.011 (3) | −0.027 (2) |
F10 | 0.068 (3) | 0.036 (2) | 0.038 (3) | 0.000 (3) | 0.001 (3) | −0.001 (2) |
F11 | 0.042 (3) | 0.042 (2) | 0.030 (2) | −0.017 (2) | 0.006 (2) | −0.016 (2) |
F12 | 0.096 (4) | 0.060 (3) | 0.043 (3) | −0.060 (3) | 0.019 (3) | −0.018 (2) |
F13 | 0.037 (2) | 0.047 (3) | 0.033 (2) | −0.022 (2) | 0.007 (2) | −0.011 (2) |
F14 | 0.092 (4) | 0.031 (3) | 0.043 (3) | −0.021 (3) | 0.003 (3) | −0.011 (2) |
F15 | 0.067 (4) | 0.109 (4) | 0.053 (3) | −0.066 (3) | −0.008 (3) | −0.008 (3) |
F16 | 0.038 (3) | 0.057 (3) | 0.031 (2) | −0.011 (2) | 0.006 (2) | −0.023 (2) |
F17 | 0.051 (3) | 0.104 (6) | 0.037 (3) | 0.000 (3) | −0.024 (3) | −0.017 (3) |
F18 | 0.120 (5) | 0.106 (5) | 0.051 (3) | −0.075 (4) | 0.008 (3) | −0.046 (3) |
O1 | 0.024 (3) | 0.029 (2) | 0.031 (3) | −0.015 (2) | −0.001 (3) | −0.015 (2) |
O2 | 0.029 (3) | 0.029 (3) | 0.023 (3) | −0.013 (2) | 0.003 (2) | −0.009 (2) |
O3 | 0.023 (3) | 0.028 (3) | 0.035 (3) | −0.003 (2) | 0.004 (2) | −0.011 (2) |
O4 | 0.028 (3) | 0.038 (3) | 0.030 (3) | 0.007 (2) | −0.004 (2) | −0.012 (2) |
O5 | 0.038 (3) | 0.033 (3) | 0.018 (2) | −0.014 (2) | 0.001 (2) | −0.011 (2) |
O6 | 0.041 (3) | 0.044 (3) | 0.034 (3) | −0.020 (2) | 0.002 (2) | −0.020 (2) |
O7 | 0.022 (3) | 0.034 (3) | 0.032 (3) | −0.012 (2) | −0.003 (2) | −0.015 (2) |
O8 | 0.028 (3) | 0.027 (2) | 0.041 (4) | −0.010 (2) | −0.004 (3) | −0.016 (2) |
K1 | 0.0263 (13) | 0.0289 (11) | 0.0318 (18) | −0.0071 (10) | −0.0013 (13) | −0.0118 (9) |
K2 | 0.0237 (12) | 0.0352 (11) | 0.0197 (16) | −0.0096 (10) | 0.0031 (12) | −0.0095 (9) |
C1—F3 | 1.297 (9) | C17—O5 | 1.260 (8) |
C1—F1 | 1.322 (9) | C17—C18 | 1.373 (11) |
C1—F2 | 1.335 (10) | C18—C19 | 1.340 (11) |
C1—C2 | 1.519 (10) | C18—H15 | 0.9500 |
C2—O1 | 1.239 (8) | C19—O6 | 1.276 (9) |
C2—C3 | 1.359 (10) | C19—C20 | 1.499 (10) |
C3—C4 | 1.345 (10) | C20—C21 | 1.335 (11) |
C3—H3 | 0.9500 | C20—C25 | 1.360 (11) |
C4—O2 | 1.261 (8) | C21—C22 | 1.386 (12) |
C4—C5 | 1.531 (10) | C21—H16 | 0.9500 |
C5—F4 | 1.288 (8) | C22—C23 | 1.369 (15) |
C5—F5 | 1.330 (9) | C22—H17 | 0.9500 |
C5—F6 | 1.334 (8) | C23—C24 | 1.435 (14) |
C6—F8 | 1.284 (9) | C23—H18 | 0.9500 |
C6—F9 | 1.339 (10) | C24—C25 | 1.396 (12) |
C6—F7 | 1.343 (8) | C24—H19 | 0.9500 |
C6—C7 | 1.504 (10) | C25—H20 | 0.9500 |
C7—O3 | 1.262 (9) | C26—F17 | 1.296 (10) |
C7—C8 | 1.325 (11) | C26—F18 | 1.310 (9) |
C8—C9 | 1.410 (10) | C26—F16 | 1.334 (9) |
C8—H8 | 0.9500 | C26—C27 | 1.545 (11) |
C9—O4 | 1.236 (8) | C27—O8 | 1.253 (8) |
C9—C10 | 1.518 (10) | C27—C28 | 1.363 (10) |
C10—C11 | 1.311 (11) | C28—C29 | 1.380 (10) |
C10—C15 | 1.345 (12) | C28—H22 | 0.9500 |
C11—C12 | 1.338 (12) | C29—O7 | 1.239 (8) |
C11—H25 | 0.9500 | C29—C30 | 1.524 (10) |
C12—C13 | 1.423 (14) | C30—F13 | 1.297 (8) |
C12—H26 | 0.9500 | C30—F14 | 1.312 (9) |
C13—C14 | 1.347 (13) | C30—F15 | 1.323 (9) |
C13—H27 | 0.9500 | Eu1—O4 | 2.294 (5) |
C14—C15 | 1.361 (12) | Eu1—O6 | 2.315 (5) |
C14—H28 | 0.9500 | Eu1—O5 | 2.367 (4) |
C15—H29 | 0.9500 | Eu1—O3 | 2.368 (4) |
C16—F10 | 1.307 (10) | Eu1—O8 | 2.394 (5) |
C16—F11 | 1.310 (8) | Eu1—O2 | 2.400 (5) |
C16—F12 | 1.315 (9) | Eu1—O7 | 2.412 (4) |
C16—C17 | 1.531 (10) | Eu1—O1 | 2.413 (5) |
F3—C1—F1 | 108.5 (7) | C16—F11—K1 | 119.4 (4) |
F3—C1—F2 | 107.2 (7) | C30—F13—K2 | 127.8 (4) |
F1—C1—F2 | 106.0 (6) | C26—F16—K1 | 121.0 (4) |
F3—C1—C2 | 113.2 (7) | C2—O1—Eu1 | 133.2 (4) |
F1—C1—C2 | 112.7 (7) | C2—O1—K2 | 125.6 (4) |
F2—C1—C2 | 108.8 (7) | Eu1—O1—K2 | 98.37 (15) |
O1—C2—C3 | 128.0 (7) | C4—O2—Eu1 | 133.7 (4) |
O1—C2—C1 | 113.1 (6) | C4—O2—K1 | 129.6 (4) |
C3—C2—C1 | 118.9 (7) | Eu1—O2—K1 | 95.34 (15) |
C4—C3—C2 | 122.7 (7) | C7—O3—Eu1 | 133.5 (5) |
C4—C3—H3 | 118.7 | C7—O3—K2 | 122.7 (4) |
C2—C3—H3 | 118.7 | Eu1—O3—K2 | 98.83 (15) |
O2—C4—C3 | 128.6 (6) | C9—O4—Eu1 | 141.3 (5) |
O2—C4—C5 | 114.3 (6) | C17—O5—Eu1 | 132.8 (4) |
C3—C4—C5 | 117.1 (6) | C17—O5—K1 | 120.0 (4) |
F4—C5—F5 | 109.1 (6) | Eu1—O5—K1 | 99.91 (15) |
F4—C5—F6 | 107.6 (6) | C19—O6—Eu1 | 138.0 (5) |
F5—C5—F6 | 105.5 (6) | C29—O7—Eu1 | 134.9 (5) |
F4—C5—C4 | 112.5 (6) | C29—O7—K2 | 128.1 (4) |
F5—C5—C4 | 110.0 (6) | Eu1—O7—K2 | 95.88 (14) |
F6—C5—C4 | 111.9 (6) | C27—O8—Eu1 | 133.6 (5) |
F8—C6—F9 | 107.5 (7) | C27—O8—K1 | 124.7 (4) |
F8—C6—F7 | 108.2 (7) | Eu1—O8—K1 | 98.81 (14) |
F9—C6—F7 | 104.3 (6) | O5i—K1—O5 | 180.0 |
F8—C6—C7 | 115.2 (7) | O5i—K1—O8i | 65.46 (14) |
F9—C6—C7 | 110.2 (7) | O5—K1—O8i | 114.54 (14) |
F7—C6—C7 | 110.9 (6) | O5i—K1—O8 | 114.54 (14) |
O3—C7—C8 | 128.2 (7) | O5—K1—O8 | 65.46 (14) |
O3—C7—C6 | 114.5 (7) | O8i—K1—O8 | 180.0 |
C8—C7—C6 | 117.4 (7) | O5i—K1—F6 | 74.59 (13) |
C7—C8—C9 | 123.1 (7) | O5—K1—F6 | 105.41 (13) |
C7—C8—H8 | 118.4 | O8i—K1—F6 | 75.14 (14) |
C9—C8—H8 | 118.4 | O8—K1—F6 | 104.86 (14) |
O4—C9—C8 | 122.1 (7) | O5i—K1—F6i | 105.41 (13) |
O4—C9—C10 | 116.4 (6) | O5—K1—F6i | 74.59 (13) |
C8—C9—C10 | 121.5 (7) | O8i—K1—F6i | 104.86 (14) |
C11—C10—C15 | 121.9 (8) | O8—K1—F6i | 75.14 (14) |
C11—C10—C9 | 118.3 (7) | F6—K1—F6i | 180.0 |
C15—C10—C9 | 119.6 (7) | O5i—K1—O2i | 62.26 (13) |
C10—C11—C12 | 121.7 (9) | O5—K1—O2i | 117.74 (13) |
C10—C11—H25 | 119.1 | O8i—K1—O2i | 60.32 (14) |
C12—C11—H25 | 119.1 | O8—K1—O2i | 119.68 (14) |
C11—C12—C13 | 118.4 (9) | F6—K1—O2i | 127.09 (12) |
C11—C12—H26 | 120.8 | F6i—K1—O2i | 52.91 (12) |
C13—C12—H26 | 120.8 | O5i—K1—O2 | 117.74 (13) |
C14—C13—C12 | 116.9 (9) | O5—K1—O2 | 62.26 (13) |
C14—C13—H27 | 121.5 | O8i—K1—O2 | 119.68 (14) |
C12—C13—H27 | 121.5 | O8—K1—O2 | 60.32 (14) |
C13—C14—C15 | 123.0 (9) | F6—K1—O2 | 52.91 (12) |
C13—C14—H28 | 118.5 | F6i—K1—O2 | 127.09 (12) |
C15—C14—H28 | 118.5 | O2i—K1—O2 | 180.000 (1) |
C10—C15—C14 | 117.2 (8) | O5i—K1—F11i | 56.45 (12) |
C10—C15—H29 | 121.4 | O5—K1—F11i | 123.55 (12) |
C14—C15—H29 | 121.4 | O8i—K1—F11i | 113.43 (13) |
F10—C16—F11 | 108.0 (7) | O8—K1—F11i | 66.57 (13) |
F10—C16—F12 | 105.7 (6) | F6—K1—F11i | 61.25 (13) |
F11—C16—F12 | 107.2 (6) | F6i—K1—F11i | 118.75 (13) |
F10—C16—C17 | 109.8 (7) | O2i—K1—F11i | 110.84 (11) |
F11—C16—C17 | 112.5 (6) | O2—K1—F11i | 69.16 (11) |
F12—C16—C17 | 113.2 (7) | O5i—K1—F11 | 123.55 (12) |
O5—C17—C18 | 128.8 (7) | O5—K1—F11 | 56.45 (12) |
O5—C17—C16 | 112.7 (7) | O8i—K1—F11 | 66.57 (13) |
C18—C17—C16 | 118.4 (7) | O8—K1—F11 | 113.43 (13) |
C19—C18—C17 | 122.5 (8) | F6—K1—F11 | 118.75 (13) |
C19—C18—H15 | 118.7 | F6i—K1—F11 | 61.25 (13) |
C17—C18—H15 | 118.7 | O2i—K1—F11 | 69.16 (11) |
O6—C19—C18 | 125.3 (7) | O2—K1—F11 | 110.84 (11) |
O6—C19—C20 | 113.3 (7) | F11i—K1—F11 | 180.000 (1) |
C18—C19—C20 | 121.3 (7) | O5i—K1—F16i | 111.12 (13) |
C21—C20—C25 | 121.3 (7) | O5—K1—F16i | 68.88 (13) |
C21—C20—C19 | 118.3 (7) | O8i—K1—F16i | 55.40 (12) |
C25—C20—C19 | 120.3 (7) | O8—K1—F16i | 124.60 (12) |
C20—C21—C22 | 120.5 (8) | F6—K1—F16i | 59.70 (13) |
C20—C21—H16 | 119.7 | F6i—K1—F16i | 120.30 (13) |
C22—C21—H16 | 119.7 | O2i—K1—F16i | 108.34 (12) |
C23—C22—C21 | 119.3 (9) | O2—K1—F16i | 71.66 (12) |
C23—C22—H17 | 120.4 | F11i—K1—F16i | 120.65 (12) |
C21—C22—H17 | 120.4 | F11—K1—F16i | 59.35 (12) |
C22—C23—C24 | 121.4 (10) | O5i—K1—F16 | 68.88 (13) |
C22—C23—H18 | 119.3 | O5—K1—F16 | 111.12 (13) |
C24—C23—H18 | 119.3 | O8i—K1—F16 | 124.60 (12) |
C25—C24—C23 | 115.3 (10) | O8—K1—F16 | 55.40 (12) |
C25—C24—H19 | 122.4 | F6—K1—F16 | 120.30 (13) |
C23—C24—H19 | 122.4 | F6i—K1—F16 | 59.70 (13) |
C20—C25—C24 | 122.0 (8) | O2i—K1—F16 | 71.66 (12) |
C20—C25—H20 | 119.0 | O2—K1—F16 | 108.34 (12) |
C24—C25—H20 | 119.0 | F11i—K1—F16 | 59.35 (12) |
F17—C26—F18 | 109.0 (7) | F11—K1—F16 | 120.65 (12) |
F17—C26—F16 | 107.3 (7) | F16i—K1—F16 | 180.00 (14) |
F18—C26—F16 | 106.6 (7) | O1ii—K2—O1 | 180.0 |
F17—C26—C27 | 111.0 (7) | O1ii—K2—O3ii | 65.99 (14) |
F18—C26—C27 | 111.8 (7) | O1—K2—O3ii | 114.01 (14) |
F16—C26—C27 | 110.9 (7) | O1ii—K2—O3 | 114.01 (14) |
O8—C27—C28 | 128.3 (7) | O1—K2—O3 | 65.99 (14) |
O8—C27—C26 | 113.8 (7) | O3ii—K2—O3 | 180.00 (16) |
C28—C27—C26 | 117.9 (7) | O1ii—K2—F13ii | 105.49 (12) |
C27—C28—C29 | 122.0 (6) | O1—K2—F13ii | 74.51 (12) |
C27—C28—H22 | 119.0 | O3ii—K2—F13ii | 107.25 (13) |
C29—C28—H22 | 119.0 | O3—K2—F13ii | 72.75 (13) |
O7—C29—C28 | 127.5 (7) | O1ii—K2—F13 | 74.51 (12) |
O7—C29—C30 | 114.9 (6) | O1—K2—F13 | 105.49 (12) |
C28—C29—C30 | 117.6 (6) | O3ii—K2—F13 | 72.75 (13) |
F13—C30—F14 | 109.0 (6) | O3—K2—F13 | 107.25 (13) |
F13—C30—F15 | 106.0 (6) | F13ii—K2—F13 | 180.0 |
F14—C30—F15 | 107.1 (6) | O1ii—K2—O7ii | 60.91 (12) |
F13—C30—C29 | 113.6 (6) | O1—K2—O7ii | 119.09 (12) |
F14—C30—C29 | 110.4 (6) | O3ii—K2—O7ii | 62.65 (13) |
F15—C30—C29 | 110.5 (6) | O3—K2—O7ii | 117.35 (13) |
O4—Eu1—O6 | 104.33 (17) | F13ii—K2—O7ii | 53.95 (11) |
O4—Eu1—O5 | 76.78 (17) | F13—K2—O7ii | 126.05 (11) |
O6—Eu1—O5 | 71.91 (16) | O1ii—K2—O7 | 119.09 (12) |
O4—Eu1—O3 | 70.88 (16) | O1—K2—O7 | 60.91 (12) |
O6—Eu1—O3 | 78.60 (17) | O3ii—K2—O7 | 117.35 (13) |
O5—Eu1—O3 | 128.55 (14) | O3—K2—O7 | 62.65 (13) |
O4—Eu1—O8 | 72.72 (18) | F13ii—K2—O7 | 126.05 (11) |
O6—Eu1—O8 | 149.11 (16) | F13—K2—O7 | 53.95 (11) |
O5—Eu1—O8 | 77.60 (16) | O7ii—K2—O7 | 180.0 |
O3—Eu1—O8 | 126.22 (16) | O1ii—K2—F7 | 66.14 (13) |
O4—Eu1—O2 | 139.43 (16) | O1—K2—F7 | 113.86 (13) |
O6—Eu1—O2 | 94.56 (17) | O3ii—K2—F7 | 124.48 (12) |
O5—Eu1—O2 | 75.54 (15) | O3—K2—F7 | 55.52 (12) |
O3—Eu1—O2 | 149.11 (16) | F13ii—K2—F7 | 61.71 (13) |
O8—Eu1—O2 | 72.79 (16) | F13—K2—F7 | 118.29 (13) |
O4—Eu1—O7 | 97.01 (17) | O7ii—K2—F7 | 70.51 (12) |
O6—Eu1—O7 | 138.70 (16) | O7—K2—F7 | 109.49 (12) |
O5—Eu1—O7 | 148.45 (15) | O1ii—K2—F7ii | 113.86 (13) |
O3—Eu1—O7 | 75.60 (15) | O1—K2—F7ii | 66.14 (13) |
O8—Eu1—O7 | 71.08 (16) | O3ii—K2—F7ii | 55.52 (12) |
O2—Eu1—O7 | 91.44 (13) | O3—K2—F7ii | 124.48 (12) |
O4—Eu1—O1 | 149.01 (16) | F13ii—K2—F7ii | 118.29 (13) |
O6—Eu1—O1 | 71.28 (16) | F13—K2—F7ii | 61.71 (13) |
O5—Eu1—O1 | 127.16 (15) | O7ii—K2—F7ii | 109.49 (12) |
O3—Eu1—O1 | 78.24 (17) | O7—K2—F7ii | 70.51 (12) |
O8—Eu1—O1 | 126.86 (13) | F7—K2—F7ii | 180.0 |
O2—Eu1—O1 | 71.08 (16) | O1ii—K2—F1 | 125.14 (13) |
O7—Eu1—O1 | 72.26 (15) | O1—K2—F1 | 54.86 (13) |
O4—Eu1—K2 | 107.55 (12) | O3ii—K2—F1 | 69.57 (13) |
O6—Eu1—K2 | 93.08 (12) | O3—K2—F1 | 110.43 (13) |
O5—Eu1—K2 | 164.99 (11) | F13ii—K2—F1 | 59.77 (12) |
O3—Eu1—K2 | 44.52 (11) | F13—K2—F1 | 120.23 (12) |
O8—Eu1—K2 | 117.38 (12) | O7ii—K2—F1 | 71.04 (12) |
O2—Eu1—K2 | 106.88 (10) | O7—K2—F1 | 108.96 (12) |
O7—Eu1—K2 | 46.38 (11) | F7—K2—F1 | 121.13 (12) |
O1—Eu1—K2 | 44.11 (10) | F7ii—K2—F1 | 58.87 (12) |
O4—Eu1—K1 | 92.65 (12) | O1ii—K2—F1ii | 54.86 (13) |
O6—Eu1—K1 | 106.80 (12) | O1—K2—F1ii | 125.14 (13) |
O5—Eu1—K1 | 43.66 (10) | O3ii—K2—F1ii | 110.43 (13) |
O3—Eu1—K1 | 163.53 (12) | O3—K2—F1ii | 69.57 (13) |
O8—Eu1—K1 | 44.13 (11) | F13ii—K2—F1ii | 120.23 (12) |
O2—Eu1—K1 | 47.16 (11) | F13—K2—F1ii | 59.77 (12) |
O7—Eu1—K1 | 107.07 (11) | O7ii—K2—F1ii | 108.96 (12) |
O1—Eu1—K1 | 118.19 (12) | O7—K2—F1ii | 71.04 (12) |
K2—Eu1—K1 | 147.309 (12) | F7—K2—F1ii | 58.87 (12) |
C1—F1—K2 | 120.3 (4) | F7ii—K2—F1ii | 121.13 (12) |
C5—F6—K1 | 129.9 (4) | F1—K2—F1ii | 180.0 |
C6—F7—K2 | 121.4 (4) | ||
F3—C1—C2—O1 | −161.2 (7) | O7—C29—C30—F15 | −132.4 (7) |
F1—C1—C2—O1 | −37.6 (9) | C28—C29—C30—F15 | 47.2 (9) |
F2—C1—C2—O1 | 79.7 (8) | C3—C2—O1—Eu1 | 20.3 (11) |
F3—C1—C2—C3 | 19.0 (11) | C1—C2—O1—Eu1 | −159.5 (5) |
F1—C1—C2—C3 | 142.6 (7) | O4—Eu1—O1—C2 | 170.4 (6) |
F2—C1—C2—C3 | −100.1 (8) | O6—Eu1—O1—C2 | 83.7 (6) |
O1—C2—C3—C4 | −4.5 (12) | O5—Eu1—O1—C2 | 35.6 (7) |
C1—C2—C3—C4 | 175.2 (7) | O3—Eu1—O1—C2 | 165.5 (6) |
C2—C3—C4—O2 | −4.5 (12) | O8—Eu1—O1—C2 | −67.8 (6) |
C2—C3—C4—C5 | 174.8 (7) | O2—Eu1—O1—C2 | −18.2 (6) |
O2—C4—C5—F4 | −132.8 (7) | O7—Eu1—O1—C2 | −116.1 (6) |
C3—C4—C5—F4 | 47.8 (9) | C3—C4—O2—Eu1 | −2.8 (11) |
O2—C4—C5—F5 | 105.4 (7) | C5—C4—O2—Eu1 | 177.9 (4) |
C3—C4—C5—F5 | −74.0 (9) | O4—Eu1—O2—C4 | −176.9 (5) |
O2—C4—C5—F6 | −11.5 (9) | O6—Eu1—O2—C4 | −58.5 (6) |
C3—C4—C5—F6 | 169.1 (6) | O5—Eu1—O2—C4 | −128.5 (6) |
F8—C6—C7—O3 | 165.1 (7) | O3—Eu1—O2—C4 | 16.8 (7) |
F9—C6—C7—O3 | −73.2 (8) | O8—Eu1—O2—C4 | 150.2 (6) |
F7—C6—C7—O3 | 41.8 (10) | O7—Eu1—O2—C4 | 80.6 (6) |
F8—C6—C7—C8 | −15.8 (11) | O1—Eu1—O2—C4 | 9.9 (6) |
F9—C6—C7—C8 | 106.0 (9) | C8—C7—O3—Eu1 | −13.1 (12) |
F7—C6—C7—C8 | −139.1 (8) | C6—C7—O3—Eu1 | 165.9 (5) |
O3—C7—C8—C9 | 3.2 (14) | O4—Eu1—O3—C7 | 10.3 (6) |
C6—C7—C8—C9 | −175.8 (7) | O6—Eu1—O3—C7 | −99.4 (6) |
C7—C8—C9—O4 | 5.1 (13) | O5—Eu1—O3—C7 | −43.9 (7) |
C7—C8—C9—C10 | −175.6 (8) | O8—Eu1—O3—C7 | 60.2 (7) |
O4—C9—C10—C11 | 15.6 (11) | O2—Eu1—O3—C7 | −179.1 (6) |
C8—C9—C10—C11 | −163.8 (9) | O7—Eu1—O3—C7 | 113.1 (7) |
O4—C9—C10—C15 | −168.9 (8) | O1—Eu1—O3—C7 | −172.4 (6) |
C8—C9—C10—C15 | 11.7 (12) | C8—C9—O4—Eu1 | −3.8 (12) |
C15—C10—C11—C12 | 11.7 (16) | C10—C9—O4—Eu1 | 176.9 (5) |
C9—C10—C11—C12 | −172.9 (9) | O6—Eu1—O4—C9 | 70.1 (8) |
C10—C11—C12—C13 | −8.0 (17) | O5—Eu1—O4—C9 | 137.2 (8) |
C11—C12—C13—C14 | 3.1 (16) | O3—Eu1—O4—C9 | −2.2 (7) |
C12—C13—C14—C15 | −1.8 (16) | O8—Eu1—O4—C9 | −141.9 (8) |
C11—C10—C15—C14 | −9.7 (16) | O2—Eu1—O4—C9 | −174.8 (7) |
C9—C10—C15—C14 | 175.0 (8) | O7—Eu1—O4—C9 | −74.2 (8) |
C13—C14—C15—C10 | 4.9 (16) | O1—Eu1—O4—C9 | −7.3 (10) |
F10—C16—C17—O5 | −75.9 (8) | C18—C17—O5—Eu1 | −10.9 (13) |
F11—C16—C17—O5 | 44.5 (9) | C16—C17—O5—Eu1 | 165.1 (5) |
F12—C16—C17—O5 | 166.3 (7) | O4—Eu1—O5—C17 | −103.0 (7) |
F10—C16—C17—C18 | 100.6 (9) | O6—Eu1—O5—C17 | 7.1 (6) |
F11—C16—C17—C18 | −139.0 (8) | O3—Eu1—O5—C17 | −51.1 (7) |
F12—C16—C17—C18 | −17.2 (11) | O8—Eu1—O5—C17 | −177.9 (7) |
O5—C17—C18—C19 | 5.4 (15) | O2—Eu1—O5—C17 | 107.0 (7) |
C16—C17—C18—C19 | −170.5 (8) | O7—Eu1—O5—C17 | 175.2 (6) |
C17—C18—C19—O6 | 1.4 (15) | O1—Eu1—O5—C17 | 55.0 (7) |
C17—C18—C19—C20 | 177.2 (8) | C18—C19—O6—Eu1 | −2.4 (14) |
O6—C19—C20—C21 | 15.3 (12) | C20—C19—O6—Eu1 | −178.4 (5) |
C18—C19—C20—C21 | −161.0 (10) | O4—Eu1—O6—C19 | 69.7 (8) |
O6—C19—C20—C25 | −165.8 (8) | O5—Eu1—O6—C19 | −0.9 (7) |
C18—C19—C20—C25 | 18.0 (13) | O3—Eu1—O6—C19 | 136.4 (8) |
C25—C20—C21—C22 | −3.7 (17) | O8—Eu1—O6—C19 | −10.5 (10) |
C19—C20—C21—C22 | 175.3 (9) | O2—Eu1—O6—C19 | −74.1 (8) |
C20—C21—C22—C23 | 3.0 (18) | O7—Eu1—O6—C19 | −171.5 (7) |
C21—C22—C23—C24 | 0.7 (18) | O1—Eu1—O6—C19 | −142.3 (8) |
C22—C23—C24—C25 | −3.6 (18) | C28—C29—O7—Eu1 | 0.9 (11) |
C21—C20—C25—C24 | 0.5 (15) | C30—C29—O7—Eu1 | −179.5 (5) |
C19—C20—C25—C24 | −178.4 (9) | O4—Eu1—O7—C29 | −60.7 (6) |
C23—C24—C25—C20 | 3.0 (16) | O6—Eu1—O7—C29 | 178.1 (6) |
F17—C26—C27—O8 | 79.2 (8) | O5—Eu1—O7—C29 | 15.4 (8) |
F18—C26—C27—O8 | −158.8 (7) | O3—Eu1—O7—C29 | −128.9 (6) |
F16—C26—C27—O8 | −40.0 (9) | O8—Eu1—O7—C29 | 8.3 (6) |
F17—C26—C27—C28 | −99.1 (8) | O2—Eu1—O7—C29 | 79.5 (6) |
F18—C26—C27—C28 | 22.8 (10) | O1—Eu1—O7—C29 | 149.1 (6) |
F16—C26—C27—C28 | 141.7 (7) | C28—C27—O8—Eu1 | 18.7 (12) |
O8—C27—C28—C29 | −1.5 (12) | C26—C27—O8—Eu1 | −159.4 (5) |
C26—C27—C28—C29 | 176.6 (6) | O4—Eu1—O8—C27 | 86.5 (7) |
C27—C28—C29—O7 | −8.5 (12) | O6—Eu1—O8—C27 | 175.6 (6) |
C27—C28—C29—C30 | 172.0 (7) | O5—Eu1—O8—C27 | 166.3 (7) |
O7—C29—C30—F13 | −13.5 (10) | O3—Eu1—O8—C27 | 37.2 (7) |
C28—C29—C30—F13 | 166.1 (6) | O2—Eu1—O8—C27 | −115.2 (7) |
O7—C29—C30—F14 | 109.3 (7) | O7—Eu1—O8—C27 | −17.5 (6) |
C28—C29—C30—F14 | −71.1 (9) | O1—Eu1—O8—C27 | −66.3 (7) |
Symmetry codes: (i) −x, −y+1, −z+1; (ii) −x+1, −y+1, −z. |
Experimental details
Crystal data | |
Chemical formula | K[Eu(C5HF6O2)2(C10H6F3O2)2] |
Mr | 1035.47 |
Crystal system, space group | Triclinic, P1 |
Temperature (K) | 100 |
a, b, c (Å) | 11.737 (2), 12.468 (2), 13.788 (3) |
α, β, γ (°) | 68.457 (8), 71.791 (8), 71.726 (8) |
V (Å3) | 1737.1 (5) |
Z | 2 |
Radiation type | Mo Kα |
µ (mm−1) | 2.07 |
Crystal size (mm) | 0.12 × 0.06 × 0.03 |
Data collection | |
Diffractometer | Rigaku AFC12 with Saturn 724+ CCD diffractometer |
Absorption correction | Multi-scan (ABSCOR; Higashi, 2001) |
Tmin, Tmax | 0.789, 0.941 |
No. of measured, independent and observed [I > 2σ(I)] reflections | 25336, 25336, 22905 |
Rint | 0.000 |
(sin θ/λ)max (Å−1) | 0.595 |
Refinement | |
R[F2 > 2σ(F2)], wR(F2), S | 0.096, 0.197, 3.00 |
No. of reflections | 25336 |
No. of parameters | 527 |
H-atom treatment | H-atom parameters constrained |
Δρmax, Δρmin (e Å−3) | 3.65, −3.79 |
Computer programs: CrystalClear (Rigaku/MSC, 2008), SIR97 (Altomare et al., 1999) within WinGX (Farrugia, 1999), SHELXL97 (Sheldrick, 2008), ORTEP-3 (Farrugia, 1997) and POV-RAY (Persistence of Vision, 2004).
Eu1—O4 | 2.294 (5) | Eu1—O8 | 2.394 (5) |
Eu1—O6 | 2.315 (5) | Eu1—O2 | 2.400 (5) |
Eu1—O5 | 2.367 (4) | Eu1—O7 | 2.412 (4) |
Eu1—O3 | 2.368 (4) | Eu1—O1 | 2.413 (5) |
Acknowledgements
We gratefully acknowledge the Robert A. Welch Foundation (F-1631), the Petroleum Research Fund administered by the American Chemical Society (47022-G3), the National Science Foundation (CHE-0639239, CHE-0741973 and CHE-0847763), the American Heart Association (0765078Y), the UT-CNM and UT-Austin for financial support of this research. Single crystal X-ray data were collected using instrumentation purchased with funds provided by the National Science Foundation grant No. 0741973.
References
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This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
Luminescent lanthanide complexes containing β-diketonates have many potential applications (Eliseeva & Bunzli, 2010; de Bettencourt-Dias, 1997; Stanley et al., 2010; Chen & Holliday, 2008). The solid-state crystal structure of K[Eu(hfac)2(btfac)2], where hfac = 1,1,1,5,5,5-hexafluoro-2,4-pentandionate and btfac = 4,4,4-trifluoro-1-phenyl-1,3-butanedionate, can be seen in Figure 1A. While complexes of the type A[Ln(L)4], where A = Na6+ or K+ and L = acetoacetonate derivatives, have been reported (Nockemann et al. (2005); Burns & Danford (1969)), this is the first example of a mixed ligand complex that has been structurally characterized. After removing all atoms not bound to the metal center, it is apparent that the local coordination environment around the trivalent europium ion is a slightly distorted square antiprism (Figure 1B).