Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S160053680600047X/nc6051sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S160053680600047X/nc6051Isup2.hkl |
CCDC reference: 298501
Data collection: SMART (Bruker, 2001); cell refinement: SMART; data reduction: SAINT (Bruker, 2001); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 2001); software used to prepare material for publication: SHELXTL.
[Co(C5H5)(C13H10)] | F(000) = 600 |
Mr = 290.23 | Dx = 1.381 Mg m−3 |
Monoclinic, P21/c | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: -P 2ybc | Cell parameters from 879 reflections |
a = 6.0403 (7) Å | θ = 2.3–16.9° |
b = 17.926 (2) Å | µ = 1.21 mm−1 |
c = 12.9002 (14) Å | T = 292 K |
β = 92.134 (2)° | Plate, red |
V = 1395.9 (3) Å3 | 0.40 × 0.10 × 0.06 mm |
Z = 4 |
Bruker SMART APEX CCD area-detector diffractometer | 1450 reflections with I > 2σ(I) |
Radiation source: fine-focus sealed tube | Rint = 0.056 |
Graphite monochromator | θmax = 25.0°, θmin = 2.0° |
φ and ω scans | h = −7→7 |
6946 measured reflections | k = −21→18 |
2443 independent reflections | l = −13→15 |
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)] = 0.062 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.166 | H-atom parameters constrained |
S = 1.04 | w = 1/[σ2(Fo2) + (0.0697P)2 + 0.4218P] where P = (Fo2 + 2Fc2)/3 |
2443 reflections | (Δ/σ)max < 0.001 |
209 parameters | Δρmax = 0.45 e Å−3 |
25 restraints | Δρmin = −0.38 e Å−3 |
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 | Occ. (<1) | |
C1 | 0.0189 (18) | 0.4092 (10) | 0.6140 (10) | 0.067 (5) | 0.58 (2) |
H1A | −0.1153 | 0.4292 | 0.5898 | 0.081* | 0.58 (2) |
C2 | 0.054 (4) | 0.3345 (10) | 0.6351 (15) | 0.082 (8) | 0.58 (2) |
H2A | −0.0479 | 0.2956 | 0.6340 | 0.099* | 0.58 (2) |
C3 | 0.281 (4) | 0.3325 (9) | 0.6584 (11) | 0.088 (5) | 0.58 (2) |
H3A | 0.3569 | 0.2880 | 0.6706 | 0.106* | 0.58 (2) |
C4 | 0.3873 (16) | 0.4020 (12) | 0.6622 (9) | 0.061 (4) | 0.58 (2) |
H4A | 0.5349 | 0.4127 | 0.6791 | 0.073* | 0.58 (2) |
C5 | 0.215 (3) | 0.4514 (5) | 0.6341 (8) | 0.051 (3) | 0.58 (2) |
H5A | 0.2268 | 0.5030 | 0.6294 | 0.062* | 0.58 (2) |
C6 | 0.1283 (16) | 0.3439 (8) | 0.9032 (9) | 0.086 (5) | 0.64 (2) |
H6A | 0.2062 | 0.2995 | 0.8964 | 0.104* | 0.64 (2) |
C7 | 0.2293 (16) | 0.4147 (10) | 0.9108 (7) | 0.075 (5) | 0.64 (2) |
H7A | 0.3755 | 0.4246 | 0.9314 | 0.090* | 0.64 (2) |
C8 | 0.0697 (19) | 0.4666 (7) | 0.8817 (8) | 0.070 (4) | 0.64 (2) |
H8A | 0.0827 | 0.5183 | 0.8789 | 0.084* | 0.64 (2) |
C9 | −0.1114 (10) | 0.4237 (3) | 0.8584 (4) | 0.0693 (17) | |
H9 | −0.2253 | 0.4406 | 0.8139 | 0.083* | |
C10 | −0.1187 (10) | 0.3484 (3) | 0.9074 (4) | 0.0673 (16) | |
H10 | −0.192 (9) | 0.312 (3) | 0.862 (4) | 0.081* | |
C11 | −0.2092 (10) | 0.3475 (3) | 1.0140 (4) | 0.0684 (16) | |
C12 | −0.2879 (9) | 0.3502 (3) | 1.0961 (4) | 0.0585 (14) | |
C13 | −0.3962 (10) | 0.3567 (3) | 1.1928 (4) | 0.0529 (13) | |
C14 | −0.6017 (11) | 0.3888 (3) | 1.1964 (5) | 0.0714 (17) | |
H14 | −0.6705 | 0.4061 | 1.1354 | 0.086* | |
C15 | −0.7081 (12) | 0.3959 (3) | 1.2879 (5) | 0.0819 (19) | |
H15 | −0.8461 | 0.4188 | 1.2887 | 0.098* | |
C16 | −0.6120 (13) | 0.3696 (3) | 1.3775 (5) | 0.0783 (19) | |
H16 | −0.6845 | 0.3740 | 1.4395 | 0.094* | |
C17 | −0.4084 (13) | 0.3365 (4) | 1.3760 (4) | 0.084 (2) | |
H17 | −0.3440 | 0.3176 | 1.4371 | 0.100* | |
C18 | −0.2964 (10) | 0.3308 (3) | 1.2841 (4) | 0.0670 (16) | |
H18 | −0.1557 | 0.3098 | 1.2840 | 0.080* | |
C1' | 0.092 (5) | 0.4287 (14) | 0.625 (2) | 0.067 (7)* | 0.42 (2) |
H1B | −0.0060 | 0.4684 | 0.6165 | 0.080* | 0.42 (2) |
C2' | 0.047 (5) | 0.3527 (15) | 0.621 (3) | 0.082 (11)* | 0.42 (2) |
H2B | −0.0851 | 0.3337 | 0.5926 | 0.099* | 0.42 (2) |
C3' | 0.217 (4) | 0.3068 (13) | 0.661 (2) | 0.089 (8)* | 0.42 (2) |
H3B | 0.2127 | 0.2562 | 0.6770 | 0.107* | 0.42 (2) |
C4' | 0.393 (3) | 0.3569 (14) | 0.6718 (17) | 0.061 (6)* | 0.42 (2) |
H4B | 0.5374 | 0.3440 | 0.6923 | 0.074* | 0.42 (2) |
C5' | 0.321 (5) | 0.4303 (12) | 0.6468 (16) | 0.052 (5)* | 0.42 (2) |
H5B | 0.4108 | 0.4724 | 0.6450 | 0.062* | 0.42 (2) |
C6' | 0.098 (2) | 0.3106 (11) | 0.891 (2) | 0.087 (9)* | 0.36 (2) |
H6B | 0.1276 | 0.2621 | 0.8707 | 0.104* | 0.36 (2) |
C7' | 0.243 (4) | 0.3690 (15) | 0.916 (2) | 0.075 (8)* | 0.36 (2) |
H7B | 0.3875 | 0.3667 | 0.9429 | 0.090* | 0.36 (2) |
C8' | 0.113 (2) | 0.4328 (17) | 0.890 (2) | 0.071 (8)* | 0.36 (2) |
H8B | 0.1757 | 0.4802 | 0.8938 | 0.085* | 0.36 (2) |
Co1 | 0.13462 (13) | 0.39111 (4) | 0.76675 (5) | 0.0605 (3) |
U11 | U22 | U33 | U12 | U13 | U23 | |
C1 | 0.039 (7) | 0.122 (15) | 0.040 (6) | 0.003 (7) | −0.007 (5) | −0.004 (7) |
C2 | 0.14 (2) | 0.070 (11) | 0.040 (8) | −0.045 (12) | 0.018 (8) | −0.001 (7) |
C3 | 0.139 (17) | 0.070 (13) | 0.057 (9) | 0.031 (13) | 0.036 (12) | 0.010 (8) |
C4 | 0.048 (6) | 0.077 (10) | 0.059 (6) | 0.006 (6) | 0.012 (5) | 0.000 (6) |
C5 | 0.049 (9) | 0.056 (7) | 0.049 (6) | 0.013 (7) | 0.015 (6) | 0.005 (5) |
C6 | 0.125 (13) | 0.086 (11) | 0.050 (6) | 0.078 (9) | 0.016 (7) | −0.004 (7) |
C7 | 0.045 (7) | 0.141 (16) | 0.039 (5) | 0.018 (7) | −0.013 (4) | −0.005 (7) |
C8 | 0.124 (10) | 0.039 (7) | 0.050 (6) | −0.026 (6) | 0.032 (6) | −0.020 (5) |
C9 | 0.080 (5) | 0.084 (4) | 0.045 (3) | 0.021 (4) | 0.015 (3) | 0.004 (3) |
C10 | 0.067 (5) | 0.067 (4) | 0.067 (4) | 0.000 (3) | 0.000 (3) | 0.000 (3) |
C11 | 0.087 (5) | 0.058 (4) | 0.062 (4) | 0.000 (3) | 0.024 (3) | 0.000 (3) |
C12 | 0.064 (4) | 0.060 (4) | 0.053 (3) | 0.002 (3) | 0.015 (3) | 0.004 (3) |
C13 | 0.065 (4) | 0.049 (3) | 0.046 (3) | −0.005 (3) | 0.013 (3) | 0.004 (2) |
C14 | 0.074 (5) | 0.082 (4) | 0.058 (3) | 0.016 (4) | 0.009 (3) | 0.003 (3) |
C15 | 0.080 (5) | 0.092 (5) | 0.076 (4) | 0.018 (4) | 0.020 (4) | 0.003 (4) |
C16 | 0.100 (6) | 0.071 (4) | 0.066 (4) | 0.001 (4) | 0.033 (4) | −0.003 (3) |
C17 | 0.115 (6) | 0.092 (5) | 0.043 (3) | 0.004 (4) | 0.006 (3) | 0.015 (3) |
C18 | 0.063 (4) | 0.077 (4) | 0.061 (4) | 0.008 (3) | 0.003 (3) | 0.011 (3) |
Co1 | 0.0586 (6) | 0.0835 (6) | 0.0400 (4) | −0.0033 (4) | 0.0097 (3) | −0.0077 (4) |
C1—C2 | 1.380 (10) | C13—C14 | 1.371 (8) |
C1—C5 | 1.420 (10) | C13—C18 | 1.383 (7) |
C1—Co1 | 2.091 (12) | C14—C15 | 1.371 (8) |
C1—H1A | 0.9300 | C14—H14 | 0.9300 |
C2—C3 | 1.394 (10) | C15—C16 | 1.358 (8) |
C2—Co1 | 2.023 (17) | C15—H15 | 0.9300 |
C2—H2A | 0.9300 | C16—C17 | 1.366 (9) |
C3—C4 | 1.401 (9) | C16—H16 | 0.9300 |
C3—Co1 | 1.983 (13) | C17—C18 | 1.390 (8) |
C3—H3A | 0.9300 | C17—H17 | 0.9300 |
C4—C5 | 1.405 (9) | C18—H18 | 0.9300 |
C4—Co1 | 2.083 (11) | C1'—C2' | 1.389 (10) |
C4—H4A | 0.9300 | C1'—C5' | 1.403 (10) |
C5—Co1 | 2.096 (9) | C1'—Co1 | 1.95 (3) |
C5—H5A | 0.9300 | C1'—H1B | 0.9300 |
C6—C7 | 1.410 (9) | C2'—C3' | 1.399 (10) |
C6—C10 | 1.497 (9) | C2'—Co1 | 2.06 (3) |
C6—Co1 | 1.955 (11) | C2'—H2B | 0.9300 |
C6—H6A | 0.9300 | C3'—C4' | 1.397 (10) |
C7—C8 | 1.382 (9) | C3'—Co1 | 2.11 (3) |
C7—Co1 | 1.969 (9) | C3'—H3B | 0.9300 |
C7—H7A | 0.9300 | C4'—C5' | 1.419 (10) |
C8—C9 | 1.361 (8) | C4'—Co1 | 2.11 (2) |
C8—Co1 | 2.056 (10) | C4'—H4B | 0.9300 |
C8—H8A | 0.9300 | C5'—Co1 | 2.07 (2) |
C9—C8' | 1.411 (10) | C5'—H5B | 0.9300 |
C9—C10 | 1.493 (6) | C6'—C7' | 1.393 (10) |
C9—Co1 | 2.019 (5) | C6'—Co1 | 2.18 (3) |
C9—H9 | 0.9300 | C6'—H6B | 0.9300 |
C10—C6' | 1.494 (10) | C7'—C8' | 1.420 (10) |
C10—C11 | 1.499 (7) | C7'—Co1 | 2.05 (3) |
C10—H10 | 0.98 (5) | C7'—H7B | 0.9300 |
C11—C12 | 1.178 (7) | C8'—Co1 | 1.77 (3) |
C12—C13 | 1.435 (7) | C8'—H8B | 0.9300 |
C2—C1—C5 | 111.1 (11) | C2'—C3'—Co1 | 68.5 (19) |
C2—C1—Co1 | 67.7 (8) | C4'—C3'—H3B | 129.2 |
C5—C1—Co1 | 70.3 (5) | C2'—C3'—H3B | 129.2 |
C2—C1—H1A | 124.4 | Co1—C3'—H3B | 123.4 |
C5—C1—H1A | 124.4 | C3'—C4'—C5' | 110.3 (18) |
Co1—C1—H1A | 129.2 | C3'—C4'—Co1 | 70.4 (16) |
C1—C2—C3 | 102.1 (14) | C5'—C4'—Co1 | 68.6 (12) |
C1—C2—Co1 | 73.1 (8) | C3'—C4'—H4B | 124.8 |
C3—C2—Co1 | 68.1 (9) | C5'—C4'—H4B | 124.8 |
C1—C2—H2A | 128.9 | Co1—C4'—H4B | 127.8 |
C3—C2—H2A | 128.9 | C1'—C5'—C4' | 108.6 (16) |
Co1—C2—H2A | 121.9 | C1'—C5'—Co1 | 65.2 (14) |
C2—C3—C4 | 115.5 (13) | C4'—C5'—Co1 | 71.7 (12) |
C2—C3—Co1 | 71.2 (10) | C1'—C5'—H5B | 125.7 |
C4—C3—Co1 | 73.7 (7) | C4'—C5'—H5B | 125.7 |
C2—C3—H3A | 122.3 | Co1—C5'—H5B | 128.9 |
C4—C3—H3A | 122.3 | C7'—C6'—C10 | 100.0 (14) |
Co1—C3—H3A | 124.4 | C7'—C6'—Co1 | 65.9 (15) |
C3—C4—C5 | 102.5 (10) | C10—C6'—Co1 | 85.2 (10) |
C3—C4—Co1 | 66.0 (7) | C7'—C6'—H6B | 130.0 |
C5—C4—Co1 | 70.8 (5) | C10—C6'—H6B | 130.0 |
C3—C4—H4A | 128.7 | Co1—C6'—H6B | 112.5 |
C5—C4—H4A | 128.7 | C6'—C7'—C8' | 102.5 (19) |
Co1—C4—H4A | 125.9 | C6'—C7'—Co1 | 75.8 (16) |
C4—C5—C1 | 108.4 (8) | C8'—C7'—Co1 | 57.9 (15) |
C4—C5—Co1 | 69.9 (5) | C6'—C7'—H7B | 128.8 |
C1—C5—Co1 | 70.0 (6) | C8'—C7'—H7B | 128.8 |
C4—C5—H5A | 125.8 | Co1—C7'—H7B | 128.4 |
C1—C5—H5A | 125.8 | C9—C8'—C7' | 119 (2) |
Co1—C5—H5A | 125.9 | C9—C8'—Co1 | 78.0 (10) |
C7—C6—C10 | 112.2 (8) | C7'—C8'—Co1 | 79.2 (18) |
C7—C6—Co1 | 69.5 (6) | C9—C8'—H8B | 120.3 |
C10—C6—Co1 | 93.6 (6) | C7'—C8'—H8B | 120.3 |
C7—C6—H6A | 123.9 | Co1—C8'—H8B | 113.0 |
C10—C6—H6A | 123.9 | C8'—Co1—C1' | 133.1 (12) |
Co1—C6—H6A | 105.0 | C8'—Co1—C6 | 50.8 (9) |
C8—C7—C6 | 107.0 (8) | C1'—Co1—C6 | 169.8 (10) |
C8—C7—Co1 | 73.4 (5) | C8'—Co1—C7 | 24.3 (5) |
C6—C7—Co1 | 68.4 (6) | C1'—Co1—C7 | 146.2 (9) |
C8—C7—H7A | 126.5 | C6—Co1—C7 | 42.1 (3) |
C6—C7—H7A | 126.5 | C8'—Co1—C3 | 155.3 (8) |
Co1—C7—H7A | 123.4 | C1'—Co1—C3 | 64.6 (8) |
C9—C8—C7 | 103.1 (8) | C6—Co1—C3 | 115.4 (5) |
C9—C8—Co1 | 69.0 (4) | C7—Co1—C3 | 131.1 (7) |
C7—C8—Co1 | 66.6 (5) | C8'—Co1—C9 | 43.1 (4) |
C9—C8—H8A | 128.5 | C1'—Co1—C9 | 111.8 (8) |
C7—C8—H8A | 128.5 | C6—Co1—C9 | 63.8 (3) |
Co1—C8—H8A | 127.4 | C7—Co1—C9 | 65.2 (3) |
C8—C9—C10 | 116.9 (8) | C3—Co1—C9 | 157.4 (7) |
C8'—C9—C10 | 91.4 (13) | C8'—Co1—C2 | 160.9 (8) |
C8—C9—Co1 | 72.0 (5) | C1'—Co1—C2 | 50.9 (8) |
C8'—C9—Co1 | 58.9 (11) | C6—Co1—C2 | 121.8 (7) |
C10—C9—Co1 | 91.1 (4) | C7—Co1—C2 | 162.3 (8) |
C8—C9—H9 | 121.5 | C3—Co1—C2 | 40.7 (3) |
C8'—C9—H9 | 145.3 | C9—Co1—C2 | 118.5 (7) |
C10—C9—H9 | 121.5 | C8'—Co1—C7' | 42.9 (5) |
Co1—C9—H9 | 106.1 | C1'—Co1—C7' | 166.3 (11) |
C9—C10—C6' | 108.1 (10) | C6—Co1—C7' | 23.9 (6) |
C9—C10—C6 | 89.3 (6) | C7—Co1—C7' | 23.6 (6) |
C9—C10—C11 | 114.6 (5) | C3—Co1—C7' | 115.2 (9) |
C6'—C10—C11 | 118.3 (12) | C9—Co1—C7' | 73.8 (8) |
C6—C10—C11 | 115.5 (6) | C2—Co1—C7' | 138.6 (9) |
C9—C10—H10 | 112 (3) | C8'—Co1—C8 | 18.1 (8) |
C6'—C10—H10 | 90 (3) | C1'—Co1—C8 | 115.1 (8) |
C6—C10—H10 | 112 (3) | C6—Co1—C8 | 68.0 (4) |
C11—C10—H10 | 112 (3) | C7—Co1—C8 | 40.1 (3) |
C12—C11—C10 | 176.1 (7) | C3—Co1—C8 | 163.6 (7) |
C11—C12—C13 | 176.0 (6) | C9—Co1—C8 | 39.0 (2) |
C14—C13—C18 | 118.6 (5) | C2—Co1—C8 | 152.8 (7) |
C14—C13—C12 | 120.4 (5) | C7'—Co1—C8 | 60.8 (6) |
C18—C13—C12 | 121.0 (5) | C8'—Co1—C2' | 160.4 (11) |
C13—C14—C15 | 121.5 (6) | C1'—Co1—C2' | 40.4 (5) |
C13—C14—H14 | 119.3 | C6—Co1—C2' | 131.9 (9) |
C15—C14—H14 | 119.3 | C7—Co1—C2' | 172.7 (9) |
C16—C15—C14 | 120.1 (6) | C3—Co1—C2' | 44.1 (13) |
C16—C15—H15 | 120.0 | C9—Co1—C2' | 117.7 (10) |
C14—C15—H15 | 120.0 | C2—Co1—C2' | 10.5 (8) |
C15—C16—C17 | 119.7 (6) | C7'—Co1—C2' | 149.1 (11) |
C15—C16—H16 | 120.1 | C8—Co1—C2' | 146.3 (10) |
C17—C16—H16 | 120.1 | C8'—Co1—C5' | 126.1 (10) |
C16—C17—C18 | 120.7 (6) | C1'—Co1—C5' | 40.7 (4) |
C16—C17—H17 | 119.7 | C6—Co1—C5' | 148.1 (9) |
C18—C17—H17 | 119.7 | C7—Co1—C5' | 119.0 (7) |
C13—C18—C17 | 119.4 (6) | C3—Co1—C5' | 52.0 (6) |
C13—C18—H18 | 120.3 | C9—Co1—C5' | 140.5 (8) |
C17—C18—H18 | 120.3 | C2—Co1—C5' | 70.3 (7) |
C2'—C1'—C5' | 102.5 (19) | C7'—Co1—C5' | 127.2 (10) |
C2'—C1'—Co1 | 73.8 (19) | C8—Co1—C5' | 116.1 (6) |
C5'—C1'—Co1 | 74.2 (14) | C2'—Co1—C5' | 63.7 (10) |
C2'—C1'—H1B | 128.8 | C8'—Co1—C4 | 128.6 (7) |
C5'—C1'—H1B | 128.8 | C1'—Co1—C4 | 55.8 (7) |
Co1—C1'—H1B | 116.1 | C6—Co1—C4 | 131.5 (5) |
C1'—C2'—C3' | 115 (2) | C7—Co1—C4 | 113.4 (4) |
C1'—C2'—Co1 | 65.7 (18) | C3—Co1—C4 | 40.2 (3) |
C3'—C2'—Co1 | 72.3 (19) | C9—Co1—C4 | 157.6 (6) |
C1'—C2'—H2B | 122.5 | C2—Co1—C4 | 70.3 (6) |
C3'—C2'—H2B | 122.5 | C7'—Co1—C4 | 114.3 (8) |
Co1—C2'—H2B | 131.8 | C8—Co1—C4 | 124.7 (5) |
C4'—C3'—C2' | 102 (2) | C2'—Co1—C4 | 66.8 (11) |
C4'—C3'—Co1 | 70.9 (15) | C5'—Co1—C4 | 18.6 (5) |
C5—C1—C2—C3 | −5.6 (16) | C4—C3—Co1—C7 | −77.5 (10) |
Co1—C1—C2—C3 | −62.4 (10) | C2—C3—Co1—C9 | 27.4 (19) |
C5—C1—C2—Co1 | 56.8 (9) | C4—C3—Co1—C9 | 152.3 (11) |
C1—C2—C3—C4 | 5.3 (18) | C4—C3—Co1—C2 | 124.9 (13) |
Co1—C2—C3—C4 | −60.6 (11) | C2—C3—Co1—C7' | 136.5 (12) |
C1—C2—C3—Co1 | 66.0 (10) | C4—C3—Co1—C7' | −98.5 (11) |
C2—C3—C4—C5 | −2.9 (16) | C2—C3—Co1—C8 | −152 (2) |
Co1—C3—C4—C5 | −62.2 (7) | C4—C3—Co1—C8 | −27 (3) |
C2—C3—C4—Co1 | 59.2 (12) | C2—C3—Co1—C2' | −14.8 (15) |
C3—C4—C5—C1 | −0.8 (11) | C4—C3—Co1—C2' | 110.1 (12) |
Co1—C4—C5—C1 | −59.6 (6) | C2—C3—Co1—C5' | −104.7 (12) |
C3—C4—C5—Co1 | 58.8 (7) | C4—C3—Co1—C5' | 20.2 (8) |
C2—C1—C5—C4 | 4.2 (13) | C2—C3—Co1—C4 | −124.9 (13) |
Co1—C1—C5—C4 | 59.5 (6) | C8—C9—Co1—C8' | 27.0 (12) |
C2—C1—C5—Co1 | −55.3 (10) | C10—C9—Co1—C8' | −91.0 (15) |
C10—C6—C7—C8 | −21.6 (10) | C8—C9—Co1—C1' | −103.4 (11) |
Co1—C6—C7—C8 | 63.7 (6) | C8'—C9—Co1—C1' | −130.5 (17) |
C10—C6—C7—Co1 | −85.4 (7) | C10—C9—Co1—C1' | 138.5 (9) |
C6—C7—C8—C9 | −0.6 (9) | C8—C9—Co1—C6 | 86.7 (6) |
Co1—C7—C8—C9 | 59.9 (5) | C8'—C9—Co1—C6 | 59.7 (13) |
C6—C7—C8—Co1 | −60.5 (6) | C10—C9—Co1—C6 | −31.3 (5) |
C7—C8—C9—C8' | −2 (3) | C8—C9—Co1—C7 | 39.8 (5) |
Co1—C8—C9—C8' | 57 (3) | C8'—C9—Co1—C7 | 12.8 (12) |
C7—C8—C9—C10 | 23.6 (9) | C10—C9—Co1—C7 | −78.2 (6) |
Co1—C8—C9—C10 | 81.8 (5) | C8—C9—Co1—C3 | −179.6 (13) |
C7—C8—C9—Co1 | −58.2 (6) | C8'—C9—Co1—C3 | 153.3 (18) |
C8—C9—C10—C6' | −49.1 (12) | C10—C9—Co1—C3 | 62.3 (13) |
C8'—C9—C10—C6' | −37.7 (15) | C8—C9—Co1—C2 | −159.6 (9) |
Co1—C9—C10—C6' | 21.2 (11) | C8'—C9—Co1—C2 | 173.3 (16) |
C8—C9—C10—C6 | −32.7 (8) | C10—C9—Co1—C2 | 82.3 (7) |
C8'—C9—C10—C6 | −21.3 (12) | C8—C9—Co1—C7' | 63.3 (6) |
Co1—C9—C10—C6 | 37.6 (6) | C8'—C9—Co1—C7' | 36.3 (12) |
C8—C9—C10—C11 | 85.2 (8) | C10—C9—Co1—C7' | −54.7 (7) |
C8'—C9—C10—C11 | 96.6 (12) | C8'—C9—Co1—C8 | −27.0 (12) |
Co1—C9—C10—C11 | 155.5 (5) | C10—C9—Co1—C8 | −118.0 (8) |
C7—C6—C10—C9 | 30.2 (8) | C8—C9—Co1—C2' | −147.7 (11) |
Co1—C6—C10—C9 | −39.1 (6) | C8'—C9—Co1—C2' | −174.8 (17) |
C7—C6—C10—C6' | 170 (4) | C10—C9—Co1—C2' | 94.2 (9) |
Co1—C6—C10—C6' | 101 (3) | C8—C9—Co1—C5' | −66.4 (12) |
C7—C6—C10—C11 | −86.9 (9) | C8'—C9—Co1—C5' | −93.4 (18) |
Co1—C6—C10—C11 | −156.2 (5) | C10—C9—Co1—C5' | 175.6 (10) |
C18—C13—C14—C15 | 0.3 (9) | C8—C9—Co1—C4 | −51.6 (11) |
C12—C13—C14—C15 | −179.7 (6) | C8'—C9—Co1—C4 | −78.6 (17) |
C13—C14—C15—C16 | −1.3 (10) | C10—C9—Co1—C4 | −169.6 (8) |
C14—C15—C16—C17 | 0.5 (10) | C1—C2—Co1—C8' | 95 (3) |
C15—C16—C17—C18 | 1.3 (10) | C3—C2—Co1—C8' | −154 (3) |
C14—C13—C18—C17 | 1.4 (9) | C1—C2—Co1—C1' | −15.4 (11) |
C12—C13—C18—C17 | −178.6 (6) | C3—C2—Co1—C1' | 95.7 (13) |
C16—C17—C18—C13 | −2.2 (10) | C1—C2—Co1—C6 | 155.9 (7) |
C5'—C1'—C2'—C3' | 15 (4) | C3—C2—Co1—C6 | −93.1 (11) |
Co1—C1'—C2'—C3' | −55 (3) | C1—C2—Co1—C7 | 178.0 (16) |
C5'—C1'—C2'—Co1 | 69.2 (19) | C3—C2—Co1—C7 | −71 (2) |
C1'—C2'—C3'—C4' | −13 (4) | C1—C2—Co1—C3 | −111.0 (14) |
Co1—C2'—C3'—C4' | −64 (2) | C1—C2—Co1—C9 | 80.6 (10) |
C1'—C2'—C3'—Co1 | 51 (3) | C3—C2—Co1—C9 | −168.4 (9) |
C2'—C3'—C4'—C5' | 5 (4) | C1—C2—Co1—C7' | 178.5 (12) |
Co1—C3'—C4'—C5' | −57.0 (18) | C3—C2—Co1—C7' | −70.5 (17) |
C2'—C3'—C4'—Co1 | 62 (2) | C1—C2—Co1—C8 | 52.0 (17) |
C2'—C1'—C5'—C4' | −10 (3) | C3—C2—Co1—C8 | 163.0 (10) |
Co1—C1'—C5'—C4' | 58.7 (17) | C1—C2—Co1—C2' | −8 (7) |
C2'—C1'—C5'—Co1 | −69 (2) | C3—C2—Co1—C2' | 103 (8) |
C3'—C4'—C5'—C1' | 3 (3) | C1—C2—Co1—C5' | −57.0 (9) |
Co1—C4'—C5'—C1' | −54.7 (18) | C3—C2—Co1—C5' | 54.0 (9) |
C3'—C4'—C5'—Co1 | 58 (2) | C1—C2—Co1—C4 | −76.8 (8) |
C9—C10—C6'—C7' | 45 (2) | C3—C2—Co1—C4 | 34.2 (8) |
C6—C10—C6'—C7' | 3 (2) | C6'—C7'—Co1—C8' | 114.9 (19) |
C11—C10—C6'—C7' | −88 (2) | C6'—C7'—Co1—C1' | −165 (4) |
C9—C10—C6'—Co1 | −19.7 (9) | C8'—C7'—Co1—C1' | 80 (5) |
C6—C10—C6'—Co1 | −62 (3) | C6'—C7'—Co1—C6 | 17.1 (12) |
C11—C10—C6'—Co1 | −152.0 (6) | C8'—C7'—Co1—C6 | −98 (3) |
C10—C6'—C7'—C8' | −28 (3) | C6'—C7'—Co1—C7 | 143 (3) |
Co1—C6'—C7'—C8' | 51.8 (18) | C8'—C7'—Co1—C7 | 28.2 (15) |
C10—C6'—C7'—Co1 | −80.1 (14) | C6'—C7'—Co1—C3 | −79.3 (14) |
C8—C9—C8'—C7' | 178 (5) | C8'—C7'—Co1—C3 | 165.7 (12) |
C10—C9—C8'—C7' | 20 (2) | C6'—C7'—Co1—C9 | 78.5 (11) |
Co1—C9—C8'—C7' | −70 (2) | C8'—C7'—Co1—C9 | −36.5 (11) |
C8—C9—C8'—Co1 | −112 (3) | C6'—C7'—Co1—C2 | −37 (2) |
C10—C9—C8'—Co1 | 90.5 (8) | C8'—C7'—Co1—C2 | −151.5 (12) |
C6'—C7'—C8'—C9 | 5 (3) | C6'—C7'—Co1—C8 | 118.6 (13) |
Co1—C7'—C8'—C9 | 69.5 (19) | C8'—C7'—Co1—C8 | 3.7 (10) |
C6'—C7'—C8'—Co1 | −64 (2) | C6'—C7'—Co1—C2' | −39 (3) |
C9—C8'—Co1—C1' | 75.3 (18) | C8'—C7'—Co1—C2' | −154 (2) |
C7'—C8'—Co1—C1' | −161.3 (15) | C6'—C7'—Co1—C5' | −139.4 (12) |
C9—C8'—Co1—C6 | −92.2 (11) | C8'—C7'—Co1—C5' | 105.6 (17) |
C7'—C8'—Co1—C6 | 31.2 (11) | C6'—C7'—Co1—C4 | −123.8 (11) |
C9—C8'—Co1—C7 | −151 (3) | C8'—C7'—Co1—C4 | 121.3 (13) |
C7'—C8'—Co1—C7 | −27.4 (16) | C9—C8—Co1—C8' | −92.5 (19) |
C9—C8'—Co1—C3 | −155.6 (16) | C7—C8—Co1—C8' | 23.0 (19) |
C7'—C8'—Co1—C3 | −32 (3) | C9—C8—Co1—C1' | 94.2 (11) |
C7'—C8'—Co1—C9 | 123.4 (18) | C7—C8—Co1—C1' | −150.3 (11) |
C9—C8'—Co1—C2 | −18 (4) | C9—C8—Co1—C6 | −75.2 (5) |
C7'—C8'—Co1—C2 | 105 (3) | C7—C8—Co1—C6 | 40.4 (5) |
C9—C8'—Co1—C7' | −123.4 (18) | C9—C8—Co1—C7 | −115.5 (7) |
C9—C8'—Co1—C8 | 66.9 (14) | C9—C8—Co1—C3 | 179.5 (18) |
C7'—C8'—Co1—C8 | −170 (3) | C7—C8—Co1—C3 | −65 (2) |
C9—C8'—Co1—C2' | 14 (4) | C7—C8—Co1—C9 | 115.5 (7) |
C7'—C8'—Co1—C2' | 137 (3) | C9—C8—Co1—C2 | 42.0 (16) |
C9—C8'—Co1—C5' | 128.2 (13) | C7—C8—Co1—C2 | 157.5 (14) |
C7'—C8'—Co1—C5' | −108.4 (16) | C9—C8—Co1—C7' | −100.6 (8) |
C9—C8'—Co1—C4 | 151.5 (8) | C7—C8—Co1—C7' | 15.0 (9) |
C7'—C8'—Co1—C4 | −85.1 (16) | C9—C8—Co1—C2' | 58.5 (18) |
C2'—C1'—Co1—C8' | −152.9 (16) | C7—C8—Co1—C2' | 174.0 (17) |
C5'—C1'—Co1—C8' | 98.6 (14) | C9—C8—Co1—C5' | 139.6 (10) |
C2'—C1'—Co1—C6 | −45 (5) | C7—C8—Co1—C5' | −104.9 (10) |
C5'—C1'—Co1—C6 | −153 (4) | C9—C8—Co1—C4 | 158.7 (6) |
C2'—C1'—Co1—C7 | 174.9 (16) | C7—C8—Co1—C4 | −85.8 (8) |
C5'—C1'—Co1—C7 | 66.5 (18) | C1'—C2'—Co1—C8' | 81 (4) |
C2'—C1'—Co1—C3 | 48.1 (18) | C3'—C2'—Co1—C8' | −150 (3) |
C5'—C1'—Co1—C3 | −60.4 (11) | C3'—C2'—Co1—C1' | 129 (2) |
C2'—C1'—Co1—C9 | −107.5 (17) | C1'—C2'—Co1—C6 | 170.4 (13) |
C5'—C1'—Co1—C9 | 144.0 (11) | C3'—C2'—Co1—C6 | −60 (2) |
C2'—C1'—Co1—C2 | 2 (2) | C1'—C2'—Co1—C3 | −105.1 (19) |
C5'—C1'—Co1—C2 | −106.3 (15) | C3'—C2'—Co1—C3 | 24.1 (12) |
C2'—C1'—Co1—C7' | 140 (4) | C1'—C2'—Co1—C9 | 91.8 (16) |
C5'—C1'—Co1—C7' | 32 (5) | C3'—C2'—Co1—C9 | −139.0 (15) |
C2'—C1'—Co1—C8 | −150.1 (16) | C1'—C2'—Co1—C2 | −171 (9) |
C5'—C1'—Co1—C8 | 101.5 (12) | C3'—C2'—Co1—C2 | −42 (7) |
C5'—C1'—Co1—C2' | −108 (2) | C1'—C2'—Co1—C7' | −163 (2) |
C2'—C1'—Co1—C5' | 108 (2) | C3'—C2'—Co1—C7' | −34 (3) |
C2'—C1'—Co1—C4 | 93.7 (18) | C1'—C2'—Co1—C8 | 55 (2) |
C5'—C1'—Co1—C4 | −14.7 (10) | C3'—C2'—Co1—C8 | −176.3 (10) |
C7—C6—Co1—C8' | −31.5 (7) | C1'—C2'—Co1—C5' | −43.6 (12) |
C10—C6—Co1—C8' | 80.9 (7) | C3'—C2'—Co1—C5' | 85.6 (16) |
C7—C6—Co1—C1' | −148 (4) | C1'—C2'—Co1—C4 | −63.9 (14) |
C10—C6—Co1—C1' | −36 (5) | C3'—C2'—Co1—C4 | 65.3 (14) |
C10—C6—Co1—C7 | 112.4 (8) | C1'—C5'—Co1—C8' | −116.7 (15) |
C7—C6—Co1—C3 | 124.0 (9) | C4'—C5'—Co1—C8' | 121.9 (13) |
C10—C6—Co1—C3 | −123.6 (9) | C4'—C5'—Co1—C1' | −121.5 (17) |
C7—C6—Co1—C9 | −81.1 (6) | C1'—C5'—Co1—C6 | 171.3 (14) |
C10—C6—Co1—C9 | 31.3 (5) | C4'—C5'—Co1—C6 | 49.8 (18) |
C7—C6—Co1—C2 | 170.2 (9) | C1'—C5'—Co1—C7 | −144.3 (13) |
C10—C6—Co1—C2 | −77.4 (10) | C4'—C5'—Co1—C7 | 94.2 (12) |
C7—C6—Co1—C7' | 28.9 (18) | C1'—C5'—Co1—C3 | 94.3 (14) |
C10—C6—Co1—C7' | 141 (2) | C4'—C5'—Co1—C3 | −27.1 (10) |
C7—C6—Co1—C8 | −38.4 (5) | C1'—C5'—Co1—C9 | −59.0 (15) |
C10—C6—Co1—C8 | 74.0 (5) | C4'—C5'—Co1—C9 | 179.5 (8) |
C7—C6—Co1—C2' | 174.2 (14) | C1'—C5'—Co1—C2 | 52.3 (13) |
C10—C6—Co1—C2' | −73.4 (15) | C4'—C5'—Co1—C2 | −69.2 (10) |
C7—C6—Co1—C5' | 65.8 (13) | C1'—C5'—Co1—C7' | −170.9 (15) |
C10—C6—Co1—C5' | 178.3 (11) | C4'—C5'—Co1—C7' | 67.7 (16) |
C7—C6—Co1—C4 | 79.1 (9) | C1'—C5'—Co1—C8 | −99.0 (14) |
C10—C6—Co1—C4 | −168.5 (7) | C4'—C5'—Co1—C8 | 139.6 (10) |
C8—C7—Co1—C8' | −17 (2) | C1'—C5'—Co1—C2' | 43.4 (12) |
C6—C7—Co1—C8' | 99 (2) | C4'—C5'—Co1—C2' | −78.1 (13) |
C8—C7—Co1—C1' | 53.8 (16) | C1'—C5'—Co1—C4 | 139 (3) |
C6—C7—Co1—C1' | 170.3 (15) | C4'—C5'—Co1—C4 | 17.3 (18) |
C8—C7—Co1—C6 | −116.5 (8) | C3—C4—Co1—C8' | 148.9 (14) |
C8—C7—Co1—C3 | 160.1 (8) | C5—C4—Co1—C8' | −97.1 (13) |
C6—C7—Co1—C3 | −83.4 (9) | C3—C4—Co1—C1' | −90.1 (11) |
C8—C7—Co1—C9 | −38.8 (4) | C5—C4—Co1—C1' | 23.9 (9) |
C6—C7—Co1—C9 | 77.7 (5) | C3—C4—Co1—C6 | 80.9 (11) |
C8—C7—Co1—C2 | −145 (2) | C5—C4—Co1—C6 | −165.2 (8) |
C6—C7—Co1—C2 | −28 (2) | C3—C4—Co1—C7 | 126.7 (10) |
C8—C7—Co1—C7' | −146 (2) | C5—C4—Co1—C7 | −119.3 (8) |
C6—C7—Co1—C7' | −29.3 (19) | C5—C4—Co1—C3 | 114.0 (10) |
C6—C7—Co1—C8 | 116.5 (8) | C3—C4—Co1—C9 | −152.1 (11) |
C8—C7—Co1—C5' | 96.9 (10) | C5—C4—Co1—C9 | −38.1 (12) |
C6—C7—Co1—C5' | −146.6 (10) | C3—C4—Co1—C2 | −34.6 (8) |
C8—C7—Co1—C4 | 116.7 (8) | C5—C4—Co1—C2 | 79.3 (6) |
C6—C7—Co1—C4 | −126.8 (8) | C3—C4—Co1—C7' | 100.9 (12) |
C2—C3—Co1—C8' | 160 (2) | C5—C4—Co1—C7' | −145.2 (10) |
C4—C3—Co1—C8' | −75 (2) | C3—C4—Co1—C8 | 171.1 (10) |
C2—C3—Co1—C1' | −58.7 (10) | C5—C4—Co1—C8 | −75.0 (8) |
C4—C3—Co1—C1' | 66.2 (9) | C3—C4—Co1—C2' | −45.3 (12) |
C2—C3—Co1—C6 | 110.0 (11) | C5—C4—Co1—C2' | 68.6 (9) |
C4—C3—Co1—C6 | −125.1 (9) | C3—C4—Co1—C5' | −121 (2) |
C2—C3—Co1—C7 | 157.5 (11) | C5—C4—Co1—C5' | −7 (2) |