Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536804015132/cv6334sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536804015132/cv6334Isup2.hkl |
CCDC reference: 245160
Data collection: P3 (Siemens, 1989); cell refinement: P3; data reduction: XDISK (Siemens, 1991); program(s) used to solve structure: SHELXS97 (Sheldrick, 1990); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: XP (Siemens, 1991); software used to prepare material for publication: SHELXL97.
[K(C16H30O6)][CrClO3] | F(000) = 1032 |
Mr = 492.95 | Dx = 1.463 Mg m−3 |
Orthorhombic, Pca21 | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: P 2c -2ac | Cell parameters from 24 reflections |
a = 14.693 (4) Å | θ = 12–18° |
b = 9.221 (3) Å | µ = 0.86 mm−1 |
c = 16.515 (5) Å | T = 293 K |
V = 2237.5 (12) Å3 | Prismatic, orange |
Z = 4 | 0.3 × 0.2 × 0.15 mm |
Siemens P3/PC diffractometer | Rint = 0.000 |
Radiation source: fine-focus sealed tube | θmax = 25.1°, θmin = 2.2° |
Graphite monochromator | h = 0→17 |
θ–2θ scans | k = 0→10 |
2040 measured reflections | l = −19→0 |
2040 independent reflections | 2 standard reflections every 98 reflections |
1405 reflections with I > 2σ(I) | intensity decay: 3% |
Refinement on F2 | Secondary atom site location: difference Fourier map |
Least-squares matrix: full | Hydrogen site location: inferred from neighbouring sites |
R[F2 > 2σ(F2)] = 0.035 | H-atom parameters constrained |
wR(F2) = 0.084 | w = 1/[σ2(Fo2) + (0.0557P)2] where P = (Fo2 + 2Fc2)/3 |
S = 0.94 | (Δ/σ)max < 0.001 |
2040 reflections | Δρmax = 0.21 e Å−3 |
253 parameters | Δρmin = −0.26 e Å−3 |
1 restraint | Absolute structure: Flack (1983), 0 Friedel pairs |
Primary atom site location: structure-invariant direct methods | Absolute structure parameter: 0.00 (4) |
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. For the inverted structure the Flack parameter is 0.21 (4) and _refine_ls_R_factor_gt rises from 0.0350 up to 0.0361. |
x | y | z | Uiso*/Ueq | ||
Cr1 | −0.00292 (5) | 0.34130 (9) | 0.30046 (7) | 0.0446 (2) | |
Cl1 | −0.10846 (10) | 0.44295 (17) | 0.37602 (10) | 0.0592 (4) | |
K1 | −0.13013 (8) | 0.10858 (12) | 0.14825 (8) | 0.0457 (3) | |
O1 | −0.0009 (2) | −0.0443 (3) | 0.0481 (2) | 0.0405 (8) | |
O2 | −0.1202 (2) | −0.1941 (4) | 0.1562 (2) | 0.0474 (9) | |
O3 | −0.2352 (3) | −0.0486 (4) | 0.2613 (2) | 0.0561 (10) | |
O4 | −0.2998 (2) | 0.2205 (4) | 0.2086 (3) | 0.0593 (10) | |
O5 | −0.1969 (2) | 0.3718 (4) | 0.0919 (3) | 0.0580 (11) | |
O6 | −0.0659 (2) | 0.2200 (4) | 0.0020 (2) | 0.0452 (9) | |
O7 | 0.0905 (3) | 0.3557 (6) | 0.3485 (3) | 0.0908 (17) | |
O8 | 0.0003 (4) | 0.4250 (6) | 0.2167 (3) | 0.0959 (18) | |
O9 | −0.0282 (3) | 0.1750 (4) | 0.2864 (3) | 0.0754 (13) | |
C1 | 0.0244 (3) | 0.1789 (6) | −0.0189 (3) | 0.0422 (13) | |
H1A | 0.0388 | 0.2218 | −0.0716 | 0.051* | |
C2 | 0.0273 (3) | 0.0175 (6) | −0.0277 (3) | 0.0383 (12) | |
H2A | −0.0152 | −0.0123 | −0.0702 | 0.046* | |
C3 | −0.0232 (4) | −0.1947 (5) | 0.0423 (4) | 0.0562 (16) | |
H3A | 0.0261 | −0.2470 | 0.0162 | 0.067* | |
H3B | −0.0778 | −0.2071 | 0.0100 | 0.067* | |
C4 | −0.0380 (4) | −0.2519 (6) | 0.1243 (4) | 0.0562 (16) | |
H4A | −0.0417 | −0.3569 | 0.1225 | 0.067* | |
H4B | 0.0126 | −0.2253 | 0.1589 | 0.067* | |
C5 | −0.1405 (4) | −0.2480 (6) | 0.2342 (4) | 0.0595 (16) | |
H5A | −0.0968 | −0.2108 | 0.2730 | 0.071* | |
H5B | −0.1364 | −0.3530 | 0.2342 | 0.071* | |
C6 | −0.2325 (5) | −0.2034 (7) | 0.2577 (4) | 0.0658 (18) | |
H6A | −0.2764 | −0.2383 | 0.2183 | 0.079* | |
H6B | −0.2479 | −0.2440 | 0.3101 | 0.079* | |
C7 | −0.3205 (4) | 0.0058 (8) | 0.2844 (5) | 0.0689 (18) | |
H7B | −0.3372 | −0.0325 | 0.3370 | 0.083* | |
H7C | −0.3663 | −0.0240 | 0.2455 | 0.083* | |
C8 | −0.3161 (4) | 0.1658 (8) | 0.2879 (5) | 0.075 (2) | |
H8B | −0.3730 | 0.2041 | 0.3087 | 0.090* | |
H8C | −0.2675 | 0.1957 | 0.3240 | 0.090* | |
C9 | −0.2959 (4) | 0.3741 (7) | 0.2056 (5) | 0.0697 (19) | |
H9A | −0.2453 | 0.4089 | 0.2380 | 0.084* | |
H9B | −0.3517 | 0.4151 | 0.2272 | 0.084* | |
C10 | −0.2841 (4) | 0.4180 (7) | 0.1216 (5) | 0.073 (2) | |
H10A | −0.3319 | 0.3755 | 0.0888 | 0.088* | |
H10B | −0.2888 | 0.5227 | 0.1175 | 0.088* | |
C11 | −0.1823 (4) | 0.3979 (7) | 0.0090 (5) | 0.0650 (18) | |
H11A | −0.1969 | 0.4980 | −0.0036 | 0.078* | |
H11B | −0.2217 | 0.3358 | −0.0230 | 0.078* | |
C12 | −0.0859 (4) | 0.3683 (6) | −0.0111 (5) | 0.0656 (18) | |
H12A | −0.0745 | 0.3929 | −0.0673 | 0.079* | |
H12B | −0.0466 | 0.4279 | 0.0224 | 0.079* | |
C13 | 0.0942 (4) | 0.2337 (6) | 0.0423 (4) | 0.0540 (14) | |
H13A | 0.0923 | 0.3388 | 0.0444 | 0.065* | |
H13B | 0.0794 | 0.1969 | 0.0957 | 0.065* | |
C14 | 0.1898 (4) | 0.1839 (7) | 0.0185 (4) | 0.0637 (18) | |
H14A | 0.2071 | 0.2294 | −0.0321 | 0.076* | |
H14B | 0.2329 | 0.2141 | 0.0597 | 0.076* | |
C15 | 0.1935 (4) | 0.0221 (7) | 0.0093 (4) | 0.0581 (16) | |
H15A | 0.1823 | −0.0230 | 0.0615 | 0.070* | |
H15B | 0.2538 | −0.0062 | −0.0085 | 0.070* | |
C16 | 0.1240 (4) | −0.0314 (6) | −0.0508 (3) | 0.0536 (15) | |
H16A | 0.1261 | −0.1364 | −0.0531 | 0.064* | |
H16B | 0.1389 | 0.0056 | −0.1042 | 0.064* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Cr1 | 0.0444 (4) | 0.0431 (4) | 0.0464 (4) | −0.0014 (4) | 0.0013 (4) | 0.0013 (5) |
Cl1 | 0.0506 (8) | 0.0607 (8) | 0.0663 (9) | 0.0066 (7) | 0.0079 (8) | 0.0009 (8) |
K1 | 0.0486 (6) | 0.0409 (6) | 0.0477 (6) | 0.0084 (5) | 0.0050 (6) | 0.0034 (6) |
O1 | 0.0478 (19) | 0.0305 (18) | 0.0433 (18) | −0.0024 (16) | 0.0063 (16) | −0.0047 (18) |
O2 | 0.052 (2) | 0.0434 (19) | 0.046 (2) | 0.0039 (16) | 0.0017 (19) | 0.0102 (18) |
O3 | 0.045 (2) | 0.066 (2) | 0.057 (2) | −0.0055 (19) | 0.0061 (18) | −0.003 (2) |
O4 | 0.053 (2) | 0.063 (3) | 0.062 (3) | 0.010 (2) | 0.005 (2) | −0.016 (2) |
O5 | 0.045 (2) | 0.053 (3) | 0.076 (3) | 0.0145 (18) | −0.006 (2) | 0.002 (2) |
O6 | 0.0459 (19) | 0.0311 (18) | 0.059 (2) | 0.0020 (16) | 0.0007 (19) | 0.0115 (17) |
O7 | 0.048 (2) | 0.113 (4) | 0.112 (4) | 0.017 (3) | −0.014 (3) | −0.048 (3) |
O8 | 0.116 (4) | 0.096 (4) | 0.075 (3) | 0.020 (3) | 0.034 (3) | 0.033 (3) |
O9 | 0.087 (3) | 0.055 (2) | 0.084 (4) | −0.004 (2) | 0.006 (3) | −0.016 (3) |
C1 | 0.037 (3) | 0.047 (3) | 0.043 (3) | −0.008 (2) | 0.001 (2) | 0.007 (3) |
C2 | 0.039 (3) | 0.043 (3) | 0.033 (3) | −0.004 (2) | 0.000 (2) | −0.002 (2) |
C3 | 0.064 (4) | 0.029 (3) | 0.075 (4) | 0.001 (2) | 0.018 (3) | −0.006 (3) |
C4 | 0.060 (3) | 0.035 (3) | 0.074 (5) | 0.019 (3) | 0.013 (3) | 0.014 (3) |
C5 | 0.076 (4) | 0.049 (4) | 0.053 (4) | 0.000 (3) | 0.005 (3) | 0.018 (3) |
C6 | 0.082 (5) | 0.062 (4) | 0.053 (3) | −0.021 (3) | 0.010 (4) | 0.010 (3) |
C7 | 0.055 (4) | 0.093 (5) | 0.058 (4) | −0.006 (3) | 0.015 (3) | 0.001 (4) |
C8 | 0.054 (3) | 0.103 (5) | 0.068 (5) | 0.012 (4) | 0.016 (4) | −0.027 (4) |
C9 | 0.059 (4) | 0.070 (5) | 0.081 (5) | 0.023 (3) | −0.001 (4) | −0.022 (4) |
C10 | 0.056 (4) | 0.054 (4) | 0.110 (6) | 0.023 (3) | −0.013 (4) | −0.008 (4) |
C11 | 0.064 (4) | 0.043 (4) | 0.088 (5) | 0.018 (3) | −0.006 (4) | 0.011 (4) |
C12 | 0.076 (4) | 0.035 (3) | 0.086 (5) | −0.001 (3) | −0.002 (4) | 0.013 (3) |
C13 | 0.057 (3) | 0.049 (3) | 0.056 (3) | −0.012 (3) | −0.006 (3) | −0.006 (3) |
C14 | 0.044 (3) | 0.080 (5) | 0.067 (4) | −0.006 (3) | −0.009 (3) | −0.010 (3) |
C15 | 0.044 (3) | 0.063 (4) | 0.067 (4) | 0.006 (3) | 0.004 (3) | −0.005 (3) |
C16 | 0.056 (4) | 0.059 (4) | 0.045 (3) | 0.001 (3) | 0.010 (3) | −0.004 (3) |
Cr1—O8 | 1.584 (5) | C4—H4B | 0.9700 |
Cr1—O7 | 1.592 (5) | C5—C6 | 1.466 (9) |
Cr1—O9 | 1.595 (4) | C5—H5A | 0.9700 |
Cr1—Cl1 | 2.2002 (18) | C5—H5B | 0.9700 |
Cr1—K1 | 3.7972 (17) | C6—H6A | 0.9700 |
K1—O1 | 2.886 (3) | C6—H6B | 0.9700 |
K1—O2 | 2.798 (4) | C7—C8 | 1.478 (10) |
K1—O3 | 2.823 (4) | C7—H7B | 0.9700 |
K1—O4 | 2.876 (4) | C7—H7C | 0.9700 |
K1—O5 | 2.778 (4) | C8—H8B | 0.9700 |
K1—O6 | 2.789 (4) | C8—H8C | 0.9700 |
K1—O9 | 2.797 (5) | C9—C10 | 1.456 (10) |
O1—C3 | 1.428 (6) | C9—H9A | 0.9700 |
O1—C2 | 1.436 (6) | C9—H9B | 0.9700 |
O2—C5 | 1.413 (7) | C10—H10A | 0.9700 |
O2—C4 | 1.421 (6) | C10—H10B | 0.9700 |
O3—C7 | 1.403 (7) | C11—C12 | 1.481 (9) |
O3—C6 | 1.429 (7) | C11—H11A | 0.9700 |
O4—C9 | 1.419 (7) | C11—H11B | 0.9700 |
O4—C8 | 1.424 (9) | C12—H12A | 0.9700 |
O5—C11 | 1.405 (8) | C12—H12B | 0.9700 |
O5—C10 | 1.438 (7) | C13—C14 | 1.529 (8) |
O6—C12 | 1.415 (6) | C13—H13A | 0.9700 |
O6—C1 | 1.423 (6) | C13—H13B | 0.9700 |
C1—C2 | 1.496 (7) | C14—C15 | 1.501 (9) |
C1—C13 | 1.527 (8) | C14—H14A | 0.9700 |
C1—H1A | 0.9800 | C14—H14B | 0.9700 |
C2—C16 | 1.539 (7) | C15—C16 | 1.507 (8) |
C2—H2A | 0.9800 | C15—H15A | 0.9700 |
C3—C4 | 1.470 (9) | C15—H15B | 0.9700 |
C3—H3A | 0.9700 | C16—H16A | 0.9700 |
C3—H3B | 0.9700 | C16—H16B | 0.9700 |
C4—H4A | 0.9700 | ||
O8—Cr1—O7 | 111.6 (3) | C3—C4—H4A | 109.8 |
O8—Cr1—O9 | 110.4 (3) | O2—C4—H4B | 109.8 |
O7—Cr1—O9 | 110.7 (3) | C3—C4—H4B | 109.8 |
O8—Cr1—Cl1 | 107.98 (18) | H4A—C4—H4B | 108.2 |
O7—Cr1—Cl1 | 106.85 (19) | O2—C5—C6 | 109.7 (5) |
O9—Cr1—Cl1 | 109.17 (19) | O2—C5—H5A | 109.7 |
O8—Cr1—K1 | 73.3 (2) | C6—C5—H5A | 109.7 |
O7—Cr1—K1 | 143.30 (18) | O2—C5—H5B | 109.7 |
O9—Cr1—K1 | 41.0 (2) | C6—C5—H5B | 109.7 |
Cl1—Cr1—K1 | 105.62 (5) | H5A—C5—H5B | 108.2 |
O5—K1—O6 | 60.48 (12) | O3—C6—C5 | 108.5 (5) |
O5—K1—O9 | 105.74 (13) | O3—C6—H6A | 110.0 |
O6—K1—O9 | 116.38 (12) | C5—C6—H6A | 110.0 |
O5—K1—O2 | 154.91 (12) | O3—C6—H6B | 110.0 |
O6—K1—O2 | 112.99 (11) | C5—C6—H6B | 110.0 |
O9—K1—O2 | 98.74 (12) | H6A—C6—H6B | 108.4 |
O5—K1—O3 | 118.51 (13) | O3—C7—C8 | 109.2 (5) |
O6—K1—O3 | 161.24 (12) | O3—C7—H7B | 109.8 |
O9—K1—O3 | 82.29 (14) | C8—C7—H7B | 109.8 |
O2—K1—O3 | 59.02 (11) | O3—C7—H7C | 109.8 |
O5—K1—O4 | 59.79 (13) | C8—C7—H7C | 109.8 |
O6—K1—O4 | 117.46 (12) | H7B—C7—H7C | 108.3 |
O9—K1—O4 | 95.91 (14) | O4—C8—C7 | 108.9 (6) |
O2—K1—O4 | 112.77 (12) | O4—C8—H8B | 109.9 |
O3—K1—O4 | 58.75 (12) | C7—C8—H8B | 109.9 |
O5—K1—O1 | 117.83 (12) | O4—C8—H8C | 109.9 |
O6—K1—O1 | 57.40 (10) | C7—C8—H8C | 109.9 |
O9—K1—O1 | 102.81 (12) | H8B—C8—H8C | 108.3 |
O2—K1—O1 | 60.34 (10) | O4—C9—C10 | 108.4 (6) |
O3—K1—O1 | 119.21 (11) | O4—C9—H9A | 110.0 |
O4—K1—O1 | 160.77 (12) | C10—C9—H9A | 110.0 |
O5—K1—Cr1 | 84.37 (9) | O4—C9—H9B | 110.0 |
O6—K1—Cr1 | 101.45 (8) | C10—C9—H9B | 110.0 |
O9—K1—Cr1 | 21.98 (9) | H9A—C9—H9B | 108.4 |
O2—K1—Cr1 | 120.45 (9) | O5—C10—C9 | 110.5 (5) |
O3—K1—Cr1 | 96.98 (9) | O5—C10—H10A | 109.6 |
O4—K1—Cr1 | 89.68 (9) | C9—C10—H10A | 109.6 |
O1—K1—Cr1 | 109.36 (8) | O5—C10—H10B | 109.6 |
C3—O1—C2 | 113.1 (4) | C9—C10—H10B | 109.6 |
C3—O1—K1 | 111.2 (3) | H10A—C10—H10B | 108.1 |
C2—O1—K1 | 119.7 (3) | O5—C11—C12 | 109.4 (5) |
C5—O2—C4 | 112.7 (4) | O5—C11—H11A | 109.8 |
C5—O2—K1 | 112.5 (3) | C12—C11—H11A | 109.8 |
C4—O2—K1 | 113.7 (3) | O5—C11—H11B | 109.8 |
C7—O3—C6 | 113.2 (5) | C12—C11—H11B | 109.8 |
C7—O3—K1 | 119.0 (4) | H11A—C11—H11B | 108.2 |
C6—O3—K1 | 118.0 (3) | O6—C12—C11 | 110.0 (5) |
C9—O4—C8 | 113.1 (5) | O6—C12—H12A | 109.7 |
C9—O4—K1 | 108.1 (3) | C11—C12—H12A | 109.7 |
C8—O4—K1 | 109.7 (3) | O6—C12—H12B | 109.7 |
C11—O5—C10 | 114.7 (5) | C11—C12—H12B | 109.7 |
C11—O5—K1 | 115.0 (3) | H12A—C12—H12B | 108.2 |
C10—O5—K1 | 117.3 (4) | C1—C13—C14 | 110.3 (5) |
C12—O6—C1 | 114.5 (4) | C1—C13—H13A | 109.6 |
C12—O6—K1 | 114.7 (4) | C14—C13—H13A | 109.6 |
C1—O6—K1 | 115.3 (3) | C1—C13—H13B | 109.6 |
Cr1—O9—K1 | 117.0 (3) | C14—C13—H13B | 109.6 |
O6—C1—C2 | 108.4 (4) | H13A—C13—H13B | 108.1 |
O6—C1—C13 | 112.2 (4) | C15—C14—C13 | 110.9 (5) |
C2—C1—C13 | 112.0 (4) | C15—C14—H14A | 109.5 |
O6—C1—H1A | 108.0 | C13—C14—H14A | 109.5 |
C2—C1—H1A | 108.0 | C15—C14—H14B | 109.5 |
C13—C1—H1A | 108.0 | C13—C14—H14B | 109.5 |
O1—C2—C1 | 107.6 (4) | H14A—C14—H14B | 108.0 |
O1—C2—C16 | 111.5 (4) | C14—C15—C16 | 111.6 (5) |
C1—C2—C16 | 110.0 (4) | C14—C15—H15A | 109.3 |
O1—C2—H2A | 109.2 | C16—C15—H15A | 109.3 |
C1—C2—H2A | 109.2 | C14—C15—H15B | 109.3 |
C16—C2—H2A | 109.2 | C16—C15—H15B | 109.3 |
O1—C3—C4 | 108.7 (5) | H15A—C15—H15B | 108.0 |
O1—C3—H3A | 110.0 | C15—C16—C2 | 111.4 (5) |
C4—C3—H3A | 110.0 | C15—C16—H16A | 109.3 |
O1—C3—H3B | 110.0 | C2—C16—H16A | 109.3 |
C4—C3—H3B | 110.0 | C15—C16—H16B | 109.3 |
H3A—C3—H3B | 108.3 | C2—C16—H16B | 109.3 |
O2—C4—C3 | 109.5 (5) | H16A—C16—H16B | 108.0 |
O2—C4—H4A | 109.8 | ||
O1—C3—C4—O2 | 70.3 (6) | O5—K1—O4—C8 | −153.5 (4) |
O2—C5—C6—O3 | −62.4 (6) | O6—K1—O4—C8 | −172.6 (4) |
O3—C7—C8—O4 | 64.8 (7) | O9—K1—O4—C8 | −48.7 (4) |
O4—C9—C10—O5 | −66.2 (7) | O2—K1—O4—C8 | 53.3 (4) |
O5—C11—C12—O6 | 63.4 (7) | O3—K1—O4—C8 | 28.5 (4) |
O6—C1—C2—O1 | −58.7 (5) | O1—K1—O4—C8 | 118.1 (5) |
O8—Cr1—K1—O5 | −39.5 (2) | Cr1—K1—O4—C8 | −69.9 (4) |
O7—Cr1—K1—O5 | −143.4 (4) | O6—K1—O5—C11 | 18.2 (4) |
O9—Cr1—K1—O5 | 166.5 (3) | O9—K1—O5—C11 | 130.0 (4) |
Cl1—Cr1—K1—O5 | 65.04 (11) | O2—K1—O5—C11 | −63.1 (5) |
O8—Cr1—K1—O6 | 18.8 (2) | O3—K1—O5—C11 | −140.3 (4) |
O7—Cr1—K1—O6 | −85.1 (4) | O4—K1—O5—C11 | −142.3 (4) |
O9—Cr1—K1—O6 | −135.2 (3) | O1—K1—O5—C11 | 15.8 (4) |
Cl1—Cr1—K1—O6 | 123.37 (9) | Cr1—K1—O5—C11 | 124.7 (4) |
O8—Cr1—K1—O9 | 154.1 (3) | O6—K1—O5—C10 | 157.6 (4) |
O7—Cr1—K1—O9 | 50.1 (5) | O9—K1—O5—C10 | −90.6 (4) |
Cl1—Cr1—K1—O9 | −101.4 (3) | O2—K1—O5—C10 | 76.3 (5) |
O8—Cr1—K1—O2 | 144.4 (2) | O3—K1—O5—C10 | −0.9 (5) |
O7—Cr1—K1—O2 | 40.4 (4) | O4—K1—O5—C10 | −2.9 (4) |
O9—Cr1—K1—O2 | −9.7 (3) | O1—K1—O5—C10 | 155.2 (4) |
Cl1—Cr1—K1—O2 | −111.09 (11) | Cr1—K1—O5—C10 | −95.8 (4) |
O8—Cr1—K1—O3 | −157.6 (2) | O5—K1—O6—C12 | 15.3 (3) |
O7—Cr1—K1—O3 | 98.5 (4) | O9—K1—O6—C12 | −78.6 (4) |
O9—Cr1—K1—O3 | 48.4 (3) | O2—K1—O6—C12 | 168.2 (4) |
Cl1—Cr1—K1—O3 | −53.06 (10) | O3—K1—O6—C12 | 107.5 (5) |
O8—Cr1—K1—O4 | −99.1 (2) | O4—K1—O6—C12 | 34.2 (4) |
O7—Cr1—K1—O4 | 156.9 (4) | O1—K1—O6—C12 | −167.2 (4) |
O9—Cr1—K1—O4 | 106.8 (3) | Cr1—K1—O6—C12 | −61.4 (4) |
Cl1—Cr1—K1—O4 | 5.38 (11) | O5—K1—O6—C1 | 151.5 (3) |
O8—Cr1—K1—O1 | 78.1 (2) | O9—K1—O6—C1 | 57.7 (3) |
O7—Cr1—K1—O1 | −25.9 (4) | O2—K1—O6—C1 | −55.6 (3) |
O9—Cr1—K1—O1 | −76.0 (3) | O3—K1—O6—C1 | −116.3 (4) |
Cl1—Cr1—K1—O1 | −177.40 (9) | O4—K1—O6—C1 | 170.5 (3) |
O5—K1—O1—C3 | −134.3 (4) | O1—K1—O6—C1 | −31.0 (3) |
O6—K1—O1—C3 | −136.8 (4) | Cr1—K1—O6—C1 | 74.8 (3) |
O9—K1—O1—C3 | 109.9 (4) | O8—Cr1—O9—K1 | −26.6 (3) |
O2—K1—O1—C3 | 17.1 (4) | O7—Cr1—O9—K1 | −150.7 (3) |
O3—K1—O1—C3 | 21.7 (4) | Cl1—Cr1—O9—K1 | 92.0 (2) |
O4—K1—O1—C3 | −56.7 (6) | O5—K1—O9—Cr1 | −14.0 (3) |
Cr1—K1—O1—C3 | 131.8 (4) | O6—K1—O9—Cr1 | 50.4 (3) |
O5—K1—O1—C2 | 0.6 (3) | O2—K1—O9—Cr1 | 171.6 (2) |
O6—K1—O1—C2 | −1.8 (3) | O3—K1—O9—Cr1 | −131.5 (3) |
O9—K1—O1—C2 | −115.1 (3) | O4—K1—O9—Cr1 | −74.2 (3) |
O2—K1—O1—C2 | 152.0 (3) | O1—K1—O9—Cr1 | 110.2 (3) |
O3—K1—O1—C2 | 156.6 (3) | C12—O6—C1—C2 | −162.0 (5) |
O4—K1—O1—C2 | 78.3 (4) | K1—O6—C1—C2 | 61.6 (4) |
Cr1—K1—O1—C2 | −93.3 (3) | C12—O6—C1—C13 | 73.8 (6) |
O5—K1—O2—C5 | −119.3 (4) | K1—O6—C1—C13 | −62.6 (5) |
O6—K1—O2—C5 | 171.6 (3) | C3—O1—C2—C1 | 165.1 (4) |
O9—K1—O2—C5 | 48.0 (4) | K1—O1—C2—C1 | 31.0 (5) |
O3—K1—O2—C5 | −27.5 (3) | C3—O1—C2—C16 | −74.2 (5) |
O4—K1—O2—C5 | −52.3 (4) | K1—O1—C2—C16 | 151.7 (3) |
O1—K1—O2—C5 | 147.8 (4) | C13—C1—C2—O1 | 65.6 (5) |
Cr1—K1—O2—C5 | 51.6 (4) | O6—C1—C2—C16 | 179.7 (4) |
O5—K1—O2—C4 | 111.1 (4) | C13—C1—C2—C16 | −56.0 (6) |
O6—K1—O2—C4 | 42.0 (4) | C2—O1—C3—C4 | 171.9 (4) |
O9—K1—O2—C4 | −81.7 (4) | K1—O1—C3—C4 | −50.1 (5) |
O3—K1—O2—C4 | −157.1 (4) | C5—O2—C4—C3 | 178.1 (5) |
O4—K1—O2—C4 | 178.1 (4) | K1—O2—C4—C3 | −52.4 (5) |
O1—K1—O2—C4 | 18.2 (3) | C4—O2—C5—C6 | −170.7 (5) |
Cr1—K1—O2—C4 | −78.0 (4) | K1—O2—C5—C6 | 59.2 (5) |
O5—K1—O3—C7 | 2.6 (5) | C7—O3—C6—C5 | −179.2 (5) |
O6—K1—O3—C7 | −79.1 (6) | K1—O3—C6—C5 | 35.2 (6) |
O9—K1—O3—C7 | 106.3 (4) | C6—O3—C7—C8 | 178.9 (6) |
O2—K1—O3—C7 | −148.6 (5) | K1—O3—C7—C8 | −35.9 (7) |
O4—K1—O3—C7 | 4.6 (4) | C9—O4—C8—C7 | 179.0 (5) |
O1—K1—O3—C7 | −153.3 (4) | K1—O4—C8—C7 | −60.1 (5) |
Cr1—K1—O3—C7 | 89.9 (4) | C8—O4—C9—C10 | −176.9 (5) |
O5—K1—O3—C6 | 146.1 (4) | K1—O4—C9—C10 | 61.4 (5) |
O6—K1—O3—C6 | 64.4 (6) | C11—O5—C10—C9 | 174.6 (6) |
O9—K1—O3—C6 | −110.2 (4) | K1—O5—C10—C9 | 35.1 (7) |
O2—K1—O3—C6 | −5.1 (4) | C10—O5—C11—C12 | 170.8 (5) |
O4—K1—O3—C6 | 148.1 (4) | K1—O5—C11—C12 | −48.7 (6) |
O1—K1—O3—C6 | −9.7 (4) | C1—O6—C12—C11 | 177.4 (5) |
Cr1—K1—O3—C6 | −126.6 (4) | K1—O6—C12—C11 | −45.9 (6) |
O5—K1—O4—C9 | −29.8 (4) | O6—C1—C13—C14 | 178.7 (5) |
O6—K1—O4—C9 | −48.8 (4) | C2—C1—C13—C14 | 56.5 (6) |
O9—K1—O4—C9 | 75.0 (4) | C1—C13—C14—C15 | −55.5 (7) |
O2—K1—O4—C9 | 177.1 (4) | C13—C14—C15—C16 | 56.0 (7) |
O3—K1—O4—C9 | 152.3 (4) | C14—C15—C16—C2 | −56.0 (7) |
O1—K1—O4—C9 | −118.1 (4) | O1—C2—C16—C15 | −63.7 (6) |
Cr1—K1—O4—C9 | 53.9 (4) | C1—C2—C16—C15 | 55.5 (6) |