Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536804033793/dn6188sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536804033793/dn6188Isup2.hkl |
CCDC reference: 248947
Data collection: SMART (2001); cell refinement: SMART (2001); data reduction: SAINT-Plus (1999); program(s) used to solve structure: SHELXS86 (Sheldrick, 1986); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEP-3 for Windows (Farrugia, 1997).
[Al2(CH3)2(C24H32O2S2)]4 | F(000) = 1968 |
Mr = 917.33 | Dx = 1.210 Mg m−3 |
Orthorhombic, Pccn | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: -P 2ab 2ac | Cell parameters from 8096 reflections |
a = 10.7048 (17) Å | θ = 1.9–28.3° |
b = 16.380 (3) Å | µ = 0.27 mm−1 |
c = 28.722 (5) Å | T = 110 K |
V = 5036.2 (14) Å3 | Irregular, colourless |
Z = 4 | 0.60 × 0.56 × 0.30 mm |
Bruker SMART AXS diffractometer with CCD area detector | 6270 independent reflections |
Radiation source: fine-focus sealed tube | 5520 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.033 |
ω–scans | θmax = 28.3°, θmin = 1.9° |
Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | h = −14→14 |
Tmin = 0.857, Tmax = 0.925 | k = −21→21 |
50262 measured reflections | l = −38→37 |
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)] = 0.041 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.109 | H-atom parameters not refined |
S = 1.07 | w = 1/[σ2(Fo2) + (0.0611P)2 + 2.2698P] where P = (Fo2 + 2Fc2)/3 |
6270 reflections | (Δ/σ)max = 0.001 |
280 parameters | Δρmax = 0.50 e Å−3 |
0 restraints | Δρmin = −0.24 e Å−3 |
Experimental. The values of Tmin and Tmax are 0.831245 and 1.000000 from SADABS. |
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s 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 | ||
Al | 0.46275 (4) | 0.35880 (3) | 0.137683 (15) | 0.01908 (11) | |
O1 | 0.41212 (9) | 0.33448 (6) | 0.19448 (3) | 0.0209 (2) | |
O2 | 0.41275 (9) | 0.32237 (6) | 0.08252 (3) | 0.0198 (2) | |
S1 | 0.58427 (3) | 0.22471 (2) | 0.147239 (12) | 0.02002 (9) | |
S2 | 0.25115 (3) | 0.43452 (2) | 0.130934 (11) | 0.01834 (9) | |
C1 | 0.48008 (13) | 0.29053 (8) | 0.22487 (5) | 0.0198 (3) | |
C2 | 0.56238 (13) | 0.23039 (8) | 0.20833 (5) | 0.0198 (3) | |
C3 | 0.62939 (14) | 0.17999 (8) | 0.23850 (5) | 0.0231 (3) | |
H3 | 0.6851 | 0.1401 | 0.2264 | 0.028* | |
C4 | 0.61436 (14) | 0.18830 (9) | 0.28589 (5) | 0.0258 (3) | |
C5 | 0.53686 (15) | 0.25080 (10) | 0.30215 (5) | 0.0270 (3) | |
H5 | 0.5289 | 0.2575 | 0.3349 | 0.032* | |
C6 | 0.47059 (14) | 0.30390 (9) | 0.27346 (5) | 0.0236 (3) | |
C7 | 0.68056 (17) | 0.13231 (11) | 0.31949 (6) | 0.0344 (4) | |
H7A | 0.6191 | 0.0981 | 0.3355 | 0.052* | |
H7B | 0.7264 | 0.1650 | 0.3424 | 0.052* | |
H7C | 0.7392 | 0.0975 | 0.3024 | 0.052* | |
C8 | 0.39515 (17) | 0.37582 (10) | 0.29311 (5) | 0.0309 (4) | |
C9 | 0.3996 (2) | 0.37875 (14) | 0.34647 (6) | 0.0518 (6) | |
H9A | 0.4868 | 0.3818 | 0.3568 | 0.078* | |
H9B | 0.3608 | 0.3294 | 0.3592 | 0.078* | |
H9C | 0.3541 | 0.4269 | 0.3575 | 0.078* | |
C10 | 0.4525 (2) | 0.45572 (11) | 0.27520 (7) | 0.0441 (5) | |
H10A | 0.5396 | 0.4595 | 0.2854 | 0.066* | |
H10B | 0.4052 | 0.5021 | 0.2876 | 0.066* | |
H10C | 0.4491 | 0.4566 | 0.2411 | 0.066* | |
C11 | 0.25754 (19) | 0.37165 (13) | 0.27857 (7) | 0.0434 (5) | |
H11A | 0.2119 | 0.4173 | 0.2926 | 0.065* | |
H11B | 0.2214 | 0.3199 | 0.2892 | 0.065* | |
H11C | 0.2514 | 0.3751 | 0.2446 | 0.065* | |
C12 | 0.48148 (13) | 0.14021 (8) | 0.13055 (5) | 0.0201 (3) | |
H12A | 0.4874 | 0.1318 | 0.0965 | 0.024* | |
H12B | 0.5108 | 0.0896 | 0.1459 | 0.024* | |
C13 | 0.35306 (13) | 0.37214 (8) | 0.05243 (5) | 0.0183 (3) | |
C14 | 0.26576 (13) | 0.42851 (8) | 0.06970 (5) | 0.0183 (3) | |
C15 | 0.19836 (13) | 0.48007 (8) | 0.04044 (5) | 0.0199 (3) | |
H15 | 0.1404 | 0.5180 | 0.0531 | 0.024* | |
C16 | 0.21635 (13) | 0.47573 (9) | −0.00732 (5) | 0.0214 (3) | |
C17 | 0.30564 (14) | 0.42115 (9) | −0.02419 (5) | 0.0215 (3) | |
H17 | 0.3190 | 0.4192 | −0.0569 | 0.026* | |
C18 | 0.37644 (13) | 0.36939 (8) | 0.00387 (5) | 0.0194 (3) | |
C19 | 0.14317 (15) | 0.52926 (10) | −0.04019 (5) | 0.0272 (3) | |
H19A | 0.0759 | 0.5566 | −0.0231 | 0.041* | |
H19B | 0.1073 | 0.4957 | −0.0650 | 0.041* | |
H19C | 0.1988 | 0.5703 | −0.0538 | 0.041* | |
C20 | 0.47719 (14) | 0.31349 (9) | −0.01654 (5) | 0.0232 (3) | |
C21 | 0.44543 (17) | 0.22378 (9) | −0.00741 (6) | 0.0326 (4) | |
H21A | 0.4377 | 0.2147 | 0.0262 | 0.049* | |
H21B | 0.5120 | 0.1890 | −0.0199 | 0.049* | |
H21C | 0.3663 | 0.2102 | −0.0227 | 0.049* | |
C22 | 0.60414 (15) | 0.33460 (11) | 0.00530 (6) | 0.0333 (4) | |
H22A | 0.6207 | 0.3930 | 0.0014 | 0.050* | |
H22B | 0.6700 | 0.3030 | −0.0101 | 0.050* | |
H22C | 0.6027 | 0.3212 | 0.0385 | 0.050* | |
C23 | 0.4907 (2) | 0.32461 (12) | −0.06914 (6) | 0.0399 (4) | |
H23A | 0.4110 | 0.3122 | −0.0844 | 0.060* | |
H23B | 0.5554 | 0.2876 | −0.0809 | 0.060* | |
H23C | 0.5145 | 0.3812 | −0.0759 | 0.060* | |
C24 | 0.15310 (13) | 0.34547 (8) | 0.14337 (5) | 0.0190 (3) | |
H24A | 0.1851 | 0.2979 | 0.1258 | 0.023* | |
H24B | 0.1586 | 0.3324 | 0.1770 | 0.023* | |
C25 | 0.59118 (16) | 0.44265 (10) | 0.13575 (6) | 0.0311 (3) | |
H25A | 0.6727 | 0.4180 | 0.1422 | 0.047* | |
H25B | 0.5730 | 0.4844 | 0.1592 | 0.047* | |
H25C | 0.5925 | 0.4678 | 0.1048 | 0.047* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Al | 0.0213 (2) | 0.0165 (2) | 0.0194 (2) | −0.00149 (15) | −0.00257 (15) | 0.00155 (15) |
O1 | 0.0244 (5) | 0.0205 (5) | 0.0176 (5) | 0.0045 (4) | −0.0035 (4) | 0.0015 (4) |
O2 | 0.0254 (5) | 0.0162 (4) | 0.0176 (4) | 0.0020 (4) | −0.0020 (4) | 0.0024 (4) |
S1 | 0.01894 (17) | 0.01926 (17) | 0.02185 (17) | 0.00003 (12) | 0.00031 (12) | 0.00026 (12) |
S2 | 0.02299 (18) | 0.01495 (17) | 0.01708 (17) | −0.00109 (12) | −0.00083 (12) | 0.00025 (11) |
C1 | 0.0236 (7) | 0.0158 (6) | 0.0200 (7) | −0.0002 (5) | −0.0049 (5) | 0.0012 (5) |
C2 | 0.0218 (6) | 0.0176 (6) | 0.0199 (6) | −0.0017 (5) | −0.0027 (5) | 0.0001 (5) |
C3 | 0.0236 (7) | 0.0165 (6) | 0.0292 (7) | 0.0009 (5) | −0.0027 (6) | 0.0025 (5) |
C4 | 0.0279 (7) | 0.0217 (7) | 0.0279 (7) | 0.0013 (6) | −0.0063 (6) | 0.0059 (6) |
C5 | 0.0357 (8) | 0.0254 (7) | 0.0199 (7) | 0.0027 (6) | −0.0050 (6) | 0.0025 (6) |
C6 | 0.0312 (8) | 0.0192 (6) | 0.0202 (7) | 0.0036 (6) | −0.0051 (5) | −0.0009 (5) |
C7 | 0.0388 (9) | 0.0326 (9) | 0.0317 (8) | 0.0089 (7) | −0.0044 (7) | 0.0118 (7) |
C8 | 0.0462 (10) | 0.0265 (8) | 0.0201 (7) | 0.0131 (7) | −0.0086 (6) | −0.0055 (6) |
C9 | 0.0819 (16) | 0.0511 (12) | 0.0225 (8) | 0.0329 (11) | −0.0067 (9) | −0.0100 (8) |
C10 | 0.0654 (13) | 0.0224 (8) | 0.0445 (11) | 0.0101 (8) | −0.0139 (9) | −0.0088 (7) |
C11 | 0.0409 (10) | 0.0472 (11) | 0.0423 (10) | 0.0175 (9) | −0.0010 (8) | −0.0168 (8) |
C12 | 0.0224 (7) | 0.0164 (6) | 0.0216 (7) | 0.0008 (5) | 0.0004 (5) | −0.0028 (5) |
C13 | 0.0214 (6) | 0.0145 (6) | 0.0189 (6) | −0.0029 (5) | −0.0019 (5) | 0.0030 (5) |
C14 | 0.0219 (6) | 0.0166 (6) | 0.0164 (6) | −0.0031 (5) | −0.0005 (5) | 0.0015 (5) |
C15 | 0.0209 (6) | 0.0167 (6) | 0.0221 (7) | −0.0004 (5) | 0.0000 (5) | 0.0022 (5) |
C16 | 0.0229 (7) | 0.0196 (6) | 0.0216 (7) | −0.0011 (5) | −0.0026 (5) | 0.0048 (5) |
C17 | 0.0259 (7) | 0.0207 (6) | 0.0181 (6) | −0.0021 (5) | 0.0006 (5) | 0.0024 (5) |
C18 | 0.0228 (7) | 0.0156 (6) | 0.0197 (6) | −0.0024 (5) | 0.0007 (5) | 0.0013 (5) |
C19 | 0.0280 (7) | 0.0302 (8) | 0.0233 (7) | 0.0040 (6) | −0.0022 (6) | 0.0077 (6) |
C20 | 0.0283 (7) | 0.0196 (7) | 0.0216 (7) | 0.0024 (6) | 0.0037 (5) | 0.0006 (5) |
C21 | 0.0399 (9) | 0.0183 (7) | 0.0396 (9) | −0.0003 (6) | 0.0069 (7) | −0.0027 (6) |
C22 | 0.0245 (8) | 0.0331 (8) | 0.0423 (9) | 0.0009 (6) | 0.0049 (7) | −0.0047 (7) |
C23 | 0.0534 (11) | 0.0412 (10) | 0.0252 (8) | 0.0171 (8) | 0.0118 (8) | 0.0027 (7) |
C24 | 0.0208 (6) | 0.0159 (6) | 0.0202 (6) | −0.0008 (5) | −0.0006 (5) | 0.0036 (5) |
C25 | 0.0282 (8) | 0.0248 (8) | 0.0404 (9) | −0.0080 (6) | 0.0012 (7) | −0.0015 (6) |
Al—O1 | 1.7645 (11) | C11—H11C | 0.9800 |
Al—O2 | 1.7755 (11) | C12—C24i | 1.505 (2) |
Al—C25 | 1.9441 (16) | C12—H12A | 0.9900 |
Al—S1 | 2.5673 (6) | C12—H12B | 0.9900 |
Al—S2 | 2.5897 (6) | C13—C14 | 1.4042 (19) |
O1—C1 | 1.3452 (16) | C13—C18 | 1.4180 (19) |
O2—C13 | 1.3490 (16) | C14—C15 | 1.3928 (19) |
S1—C2 | 1.7727 (15) | C15—C16 | 1.3872 (19) |
S1—C12 | 1.8320 (14) | C15—H15 | 0.9500 |
S2—C14 | 1.7685 (14) | C16—C17 | 1.395 (2) |
S2—C24 | 1.8321 (14) | C16—C19 | 1.5078 (19) |
C1—C2 | 1.4044 (19) | C17—C18 | 1.3937 (19) |
C1—C6 | 1.416 (2) | C17—H17 | 0.9500 |
C2—C3 | 1.3954 (19) | C18—C20 | 1.531 (2) |
C3—C4 | 1.377 (2) | C19—H19A | 0.9800 |
C3—H3 | 0.9500 | C19—H19B | 0.9800 |
C4—C5 | 1.398 (2) | C19—H19C | 0.9800 |
C4—C7 | 1.508 (2) | C20—C23 | 1.529 (2) |
C5—C6 | 1.392 (2) | C20—C21 | 1.531 (2) |
C5—H5 | 0.9500 | C20—C22 | 1.536 (2) |
C6—C8 | 1.536 (2) | C21—H21A | 0.9800 |
C7—H7A | 0.9800 | C21—H21B | 0.9800 |
C7—H7B | 0.9800 | C21—H21C | 0.9800 |
C7—H7C | 0.9800 | C22—H22A | 0.9800 |
C8—C11 | 1.533 (3) | C22—H22B | 0.9800 |
C8—C10 | 1.534 (3) | C22—H22C | 0.9800 |
C8—C9 | 1.534 (2) | C23—H23A | 0.9800 |
C9—H9A | 0.9800 | C23—H23B | 0.9800 |
C9—H9B | 0.9800 | C23—H23C | 0.9800 |
C9—H9C | 0.9800 | C24—C12i | 1.505 (2) |
C10—H10A | 0.9800 | C24—H24A | 0.9900 |
C10—H10B | 0.9800 | C24—H24B | 0.9900 |
C10—H10C | 0.9800 | C25—H25A | 0.9800 |
C11—H11A | 0.9800 | C25—H25B | 0.9800 |
C11—H11B | 0.9800 | C25—H25C | 0.9800 |
O1—Al—O2 | 131.03 (5) | C24i—C12—S1 | 113.14 (9) |
O1—Al—C25 | 113.77 (7) | C24i—C12—H12A | 109.0 |
O2—Al—C25 | 115.16 (7) | S1—C12—H12A | 109.0 |
O1—Al—S1 | 82.16 (4) | C24i—C12—H12B | 109.0 |
O2—Al—S1 | 87.74 (4) | S1—C12—H12B | 109.0 |
C25—Al—S1 | 104.42 (6) | H12A—C12—H12B | 107.8 |
O1—Al—S2 | 84.76 (4) | O2—C13—C14 | 119.10 (12) |
O2—Al—S2 | 80.24 (4) | O2—C13—C18 | 121.83 (12) |
C25—Al—S2 | 106.15 (6) | C14—C13—C18 | 119.06 (12) |
S1—Al—S2 | 149.42 (2) | C15—C14—C13 | 122.03 (12) |
C1—O1—Al | 123.69 (9) | C15—C14—S2 | 121.36 (11) |
C13—O2—Al | 120.75 (9) | C13—C14—S2 | 116.53 (10) |
C2—S1—C12 | 102.67 (6) | C16—C15—C14 | 119.58 (13) |
C2—S1—Al | 89.66 (5) | C16—C15—H15 | 120.2 |
C12—S1—Al | 108.30 (5) | C14—C15—H15 | 120.2 |
C14—S2—C24 | 101.56 (6) | C15—C16—C17 | 118.11 (13) |
C14—S2—Al | 88.31 (5) | C15—C16—C19 | 121.15 (13) |
C24—S2—Al | 96.04 (5) | C17—C16—C19 | 120.74 (13) |
O1—C1—C2 | 119.67 (12) | C18—C17—C16 | 124.16 (13) |
O1—C1—C6 | 121.19 (12) | C18—C17—H17 | 117.9 |
C2—C1—C6 | 119.13 (12) | C16—C17—H17 | 117.9 |
C3—C2—C1 | 121.83 (13) | C17—C18—C13 | 116.96 (13) |
C3—C2—S1 | 121.05 (11) | C17—C18—C20 | 121.70 (12) |
C1—C2—S1 | 117.04 (10) | C13—C18—C20 | 121.32 (12) |
C4—C3—C2 | 119.68 (14) | C16—C19—H19A | 109.5 |
C4—C3—H3 | 120.2 | C16—C19—H19B | 109.5 |
C2—C3—H3 | 120.2 | H19A—C19—H19B | 109.5 |
C3—C4—C5 | 118.15 (13) | C16—C19—H19C | 109.5 |
C3—C4—C7 | 121.16 (14) | H19A—C19—H19C | 109.5 |
C5—C4—C7 | 120.69 (14) | H19B—C19—H19C | 109.5 |
C6—C5—C4 | 124.21 (14) | C23—C20—C21 | 107.74 (13) |
C6—C5—H5 | 117.9 | C23—C20—C18 | 111.95 (12) |
C4—C5—H5 | 117.9 | C21—C20—C18 | 110.61 (12) |
C5—C6—C1 | 116.74 (13) | C23—C20—C22 | 107.03 (14) |
C5—C6—C8 | 121.99 (13) | C21—C20—C22 | 110.04 (13) |
C1—C6—C8 | 121.22 (13) | C18—C20—C22 | 109.40 (12) |
C4—C7—H7A | 109.5 | C20—C21—H21A | 109.5 |
C4—C7—H7B | 109.5 | C20—C21—H21B | 109.5 |
H7A—C7—H7B | 109.5 | H21A—C21—H21B | 109.5 |
C4—C7—H7C | 109.5 | C20—C21—H21C | 109.5 |
H7A—C7—H7C | 109.5 | H21A—C21—H21C | 109.5 |
H7B—C7—H7C | 109.5 | H21B—C21—H21C | 109.5 |
C11—C8—C10 | 109.33 (15) | C20—C22—H22A | 109.5 |
C11—C8—C9 | 107.68 (16) | C20—C22—H22B | 109.5 |
C10—C8—C9 | 107.20 (16) | H22A—C22—H22B | 109.5 |
C11—C8—C6 | 111.79 (13) | C20—C22—H22C | 109.5 |
C10—C8—C6 | 108.72 (15) | H22A—C22—H22C | 109.5 |
C9—C8—C6 | 112.00 (13) | H22B—C22—H22C | 109.5 |
C8—C9—H9A | 109.5 | C20—C23—H23A | 109.5 |
C8—C9—H9B | 109.5 | C20—C23—H23B | 109.5 |
H9A—C9—H9B | 109.5 | H23A—C23—H23B | 109.5 |
C8—C9—H9C | 109.5 | C20—C23—H23C | 109.5 |
H9A—C9—H9C | 109.5 | H23A—C23—H23C | 109.5 |
H9B—C9—H9C | 109.5 | H23B—C23—H23C | 109.5 |
C8—C10—H10A | 109.5 | C12i—C24—S2 | 112.12 (9) |
C8—C10—H10B | 109.5 | C12i—C24—H24A | 109.2 |
H10A—C10—H10B | 109.5 | S2—C24—H24A | 109.2 |
C8—C10—H10C | 109.5 | C12i—C24—H24B | 109.2 |
H10A—C10—H10C | 109.5 | S2—C24—H24B | 109.2 |
H10B—C10—H10C | 109.5 | H24A—C24—H24B | 107.9 |
C8—C11—H11A | 109.5 | Al—C25—H25A | 109.5 |
C8—C11—H11B | 109.5 | Al—C25—H25B | 109.5 |
H11A—C11—H11B | 109.5 | H25A—C25—H25B | 109.5 |
C8—C11—H11C | 109.5 | Al—C25—H25C | 109.5 |
H11A—C11—H11C | 109.5 | H25A—C25—H25C | 109.5 |
H11B—C11—H11C | 109.5 | H25B—C25—H25C | 109.5 |
O2—Al—O1—C1 | 108.40 (11) | O1—C1—C6—C5 | 174.81 (13) |
C25—Al—O1—C1 | −74.03 (12) | C2—C1—C6—C5 | −5.4 (2) |
S1—Al—O1—C1 | 28.33 (10) | O1—C1—C6—C8 | −7.7 (2) |
S2—Al—O1—C1 | −179.38 (10) | C2—C1—C6—C8 | 172.12 (14) |
O1—Al—O2—C13 | 112.45 (10) | C5—C6—C8—C11 | −122.78 (17) |
C25—Al—O2—C13 | −65.09 (12) | C1—C6—C8—C11 | 59.8 (2) |
S1—Al—O2—C13 | −169.97 (10) | C5—C6—C8—C10 | 116.43 (17) |
S2—Al—O2—C13 | 38.27 (9) | C1—C6—C8—C10 | −60.94 (19) |
O1—Al—S1—C2 | −17.52 (6) | C5—C6—C8—C9 | −1.8 (2) |
O2—Al—S1—C2 | −149.48 (6) | C1—C6—C8—C9 | −179.21 (17) |
C25—Al—S1—C2 | 95.10 (7) | C2—S1—C12—C24i | 58.93 (11) |
S2—Al—S1—C2 | −83.06 (6) | Al—S1—C12—C24i | −34.97 (11) |
O1—Al—S1—C12 | 85.72 (6) | Al—O2—C13—C14 | −38.93 (16) |
O2—Al—S1—C12 | −46.24 (6) | Al—O2—C13—C18 | 140.77 (11) |
C25—Al—S1—C12 | −161.66 (7) | O2—C13—C14—C15 | −178.17 (12) |
S2—Al—S1—C12 | 20.18 (7) | C18—C13—C14—C15 | 2.1 (2) |
O1—Al—S2—C14 | −159.34 (6) | O2—C13—C14—S2 | 4.92 (17) |
O2—Al—S2—C14 | −26.13 (5) | C18—C13—C14—S2 | −174.78 (10) |
C25—Al—S2—C14 | 87.41 (7) | C24—S2—C14—C15 | 103.78 (12) |
S1—Al—S2—C14 | −94.44 (6) | Al—S2—C14—C15 | −160.40 (11) |
O1—Al—S2—C24 | −57.89 (6) | C24—S2—C14—C13 | −79.29 (11) |
O2—Al—S2—C24 | 75.32 (6) | Al—S2—C14—C13 | 16.53 (10) |
C25—Al—S2—C24 | −171.15 (7) | C13—C14—C15—C16 | 0.6 (2) |
S1—Al—S2—C24 | 7.00 (6) | S2—C14—C15—C16 | 177.32 (11) |
Al—O1—C1—C2 | −30.70 (17) | C14—C15—C16—C17 | −2.2 (2) |
Al—O1—C1—C6 | 149.11 (11) | C14—C15—C16—C19 | 178.69 (13) |
O1—C1—C2—C3 | −176.18 (13) | C15—C16—C17—C18 | 1.3 (2) |
C6—C1—C2—C3 | 4.0 (2) | C19—C16—C17—C18 | −179.61 (14) |
O1—C1—C2—S1 | 7.16 (18) | C16—C17—C18—C13 | 1.3 (2) |
C6—C1—C2—S1 | −172.65 (11) | C16—C17—C18—C20 | −177.25 (13) |
C12—S1—C2—C3 | 83.90 (13) | O2—C13—C18—C17 | 177.34 (12) |
Al—S1—C2—C3 | −167.41 (11) | C14—C13—C18—C17 | −2.96 (19) |
C12—S1—C2—C1 | −99.41 (12) | O2—C13—C18—C20 | −4.1 (2) |
Al—S1—C2—C1 | 9.29 (11) | C14—C13—C18—C20 | 175.61 (12) |
C1—C2—C3—C4 | 0.6 (2) | C17—C18—C20—C23 | 1.9 (2) |
S1—C2—C3—C4 | 177.17 (11) | C13—C18—C20—C23 | −176.60 (14) |
C2—C3—C4—C5 | −3.6 (2) | C17—C18—C20—C21 | −118.27 (15) |
C2—C3—C4—C7 | 177.09 (14) | C13—C18—C20—C21 | 63.23 (18) |
C3—C4—C5—C6 | 2.0 (2) | C17—C18—C20—C22 | 120.37 (15) |
C7—C4—C5—C6 | −178.64 (16) | C13—C18—C20—C22 | −58.14 (17) |
C4—C5—C6—C1 | 2.5 (2) | C14—S2—C24—C12i | −75.62 (11) |
C4—C5—C6—C8 | −174.97 (16) | Al—S2—C24—C12i | −165.12 (9) |
Symmetry code: (i) −x+1/2, −y+1/2, z. |