Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536801006560/cv6019sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536801006560/cv6019Isup2.hkl |
CCDC reference: 170265
Data collection: SMART (Bruker, 1998); cell refinement: SMART; data reduction: SAINT (Bruker, 1998); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); software used to prepare material for publication: XP (Bruker, 1998).
[Ag(C17H20S2)2]PF6 | F(000) = 848 |
Mr = 829.74 | Dx = 1.502 Mg m−3 |
Monoclinic, Pc | Mo Kα radiation, λ = 0.71073 Å |
a = 9.3876 (10) Å | Cell parameters from 7412 reflections |
b = 10.2213 (11) Å | θ = 2.0–25.0° |
c = 19.640 (2) Å | µ = 0.87 mm−1 |
β = 103.161 (2)° | T = 293 K |
V = 1835.0 (3) Å3 | Prism, colorless |
Z = 2 | 0.30 × 0.20 × 0.20 mm |
Bruker SMART1000 diffractometer | 4522 reflections with I > 2σ(I) |
ω scans | Rint = 0.022 |
Absorption correction: multi-scan [SAINT (Bruker 1998) and SADABS (Sheldrick, 1997)] | θmax = 25.0° |
Tmin = 0.779, Tmax = 0.845 | h = −11→8 |
7412 measured reflections | k = −12→9 |
5142 independent reflections | l = −22→23 |
Refinement on F2 | H-atom parameters constrained |
R[F2 > 2σ(F2)] = 0.034 | w = 1/[σ2(Fo2) + (0.0554P)2 + 0.1885P] where P = (Fo2 + 2Fc2)/3 |
wR(F2) = 0.089 | (Δ/σ)max = 0.019 |
S = 1.02 | Δρmax = 0.52 e Å−3 |
5142 reflections | Δρmin = −0.35 e Å−3 |
415 parameters |
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. Full-MATRIX |
x | y | z | Uiso*/Ueq | ||
Ag1 | 0.82775 (2) | 0.80911 (4) | 0.101332 (17) | 0.06501 (13) | |
S1 | 0.65042 (15) | 0.83982 (12) | 0.18588 (7) | 0.0579 (3) | |
S2 | 1.01890 (15) | 0.98886 (14) | 0.09152 (8) | 0.0675 (3) | |
S3 | 0.66147 (15) | 0.81643 (12) | −0.02914 (7) | 0.0579 (3) | |
S4 | 0.90410 (16) | 0.56369 (12) | 0.11148 (7) | 0.0623 (3) | |
C1 | 0.8115 (6) | 1.3294 (4) | 0.1566 (3) | 0.0620 (13) | |
H1A | 0.9085 | 1.3122 | 0.1851 | 0.074* | |
H1B | 0.8107 | 1.3015 | 0.1093 | 0.074* | |
C2 | 0.7024 (5) | 1.2474 (5) | 0.1839 (3) | 0.0568 (12) | |
H2A | 0.6039 | 1.2691 | 0.1587 | 0.068* | |
H2B | 0.7103 | 1.2666 | 0.2330 | 0.068* | |
C3 | 0.7305 (5) | 1.1024 (5) | 0.1751 (3) | 0.0587 (12) | |
H3A | 0.7420 | 1.0875 | 0.1279 | 0.070* | |
H3B | 0.8218 | 1.0786 | 0.2070 | 0.070* | |
C4 | 0.6110 (5) | 1.0145 (5) | 0.1884 (3) | 0.0622 (13) | |
H4A | 0.5218 | 1.0331 | 0.1538 | 0.075* | |
H4B | 0.5932 | 1.0355 | 0.2340 | 0.075* | |
C5 | 1.1425 (7) | 0.9614 (6) | 0.0341 (3) | 0.0732 (15) | |
H5A | 1.0869 | 0.9679 | −0.0139 | 0.088* | |
H5B | 1.2146 | 1.0310 | 0.0416 | 0.088* | |
C6 | 0.2207 (9) | 0.8343 (6) | 0.0428 (4) | 0.0859 (19) | |
H6A | 0.1505 | 0.7637 | 0.0304 | 0.103* | |
H6B | 0.2709 | 0.8232 | 0.0914 | 0.103* | |
C7 | 0.3346 (7) | 0.8268 (6) | −0.0044 (3) | 0.0800 (17) | |
H7A | 0.2835 | 0.8335 | −0.0531 | 0.096* | |
H7B | 0.4013 | 0.9003 | 0.0062 | 0.096* | |
C8 | 0.4188 (7) | 0.7043 (6) | 0.0062 (3) | 0.0781 (16) | |
H8A | 0.3507 | 0.6316 | −0.0014 | 0.094* | |
H8B | 0.4729 | 0.7007 | 0.0545 | 0.094* | |
C9 | 0.5260 (7) | 0.6862 (6) | −0.0408 (4) | 0.0760 (16) | |
H9A | 0.4724 | 0.6844 | −0.0892 | 0.091* | |
H9B | 0.5755 | 0.6029 | −0.0303 | 0.091* | |
C10 | 0.7846 (5) | 0.4737 (5) | 0.1560 (3) | 0.0609 (13) | |
H10A | 0.7998 | 0.5048 | 0.2038 | 0.073* | |
H10B | 0.6835 | 0.4909 | 0.1329 | 0.073* | |
C11 | 0.7558 (6) | 0.8124 (4) | 0.2727 (3) | 0.0522 (11) | |
C12 | 0.6872 (7) | 0.7749 (6) | 0.3243 (3) | 0.0745 (16) | |
H12A | 0.5865 | 0.7617 | 0.3142 | 0.089* | |
C13 | 0.7713 (9) | 0.7568 (8) | 0.3927 (4) | 0.0879 (19) | |
H13A | 0.7247 | 0.7338 | 0.4280 | 0.105* | |
C14 | 0.9164 (8) | 0.7716 (6) | 0.4082 (3) | 0.0797 (17) | |
H14A | 0.9703 | 0.7572 | 0.4535 | 0.096* | |
C15 | 0.9855 (7) | 0.8083 (5) | 0.3566 (3) | 0.0742 (15) | |
H15A | 1.0864 | 0.8198 | 0.3672 | 0.089* | |
C16 | 0.9063 (6) | 0.8281 (5) | 0.2897 (3) | 0.0632 (14) | |
H16A | 0.9543 | 0.8525 | 0.2551 | 0.076* | |
C17 | 1.1472 (5) | 1.0094 (4) | 0.1724 (3) | 0.0538 (11) | |
C22 | 1.1966 (7) | 1.1346 (6) | 0.1939 (4) | 0.0796 (17) | |
H22A | 1.1653 | 1.2067 | 0.1655 | 0.095* | |
C21 | 1.2938 (9) | 1.1502 (8) | 0.2586 (5) | 0.096 (2) | |
H21A | 1.3266 | 1.2336 | 0.2734 | 0.115* | |
C20 | 1.3409 (7) | 1.0475 (8) | 0.3000 (4) | 0.0859 (18) | |
H20A | 1.4048 | 1.0599 | 0.3432 | 0.103* | |
C19 | 1.2947 (6) | 0.9249 (6) | 0.2784 (3) | 0.0694 (14) | |
H19A | 1.3287 | 0.8535 | 0.3069 | 0.083* | |
C18 | 1.1999 (6) | 0.9054 (5) | 0.2161 (3) | 0.0600 (12) | |
H18A | 1.1697 | 0.8209 | 0.2025 | 0.072* | |
C23 | 1.0804 (5) | 0.5416 (4) | 0.1671 (3) | 0.0525 (11) | |
C24 | 1.1081 (7) | 0.5607 (5) | 0.2386 (3) | 0.0673 (14) | |
H24A | 1.0319 | 0.5811 | 0.2598 | 0.081* | |
C25 | 1.2486 (9) | 0.5493 (6) | 0.2782 (4) | 0.089 (2) | |
H25A | 1.2657 | 0.5616 | 0.3263 | 0.106* | |
C26 | 1.3623 (9) | 0.5210 (7) | 0.2494 (6) | 0.105 (3) | |
H26A | 1.4569 | 0.5145 | 0.2769 | 0.126* | |
C27 | 1.3339 (8) | 0.5017 (8) | 0.1771 (6) | 0.109 (3) | |
H27A | 1.4110 | 0.4825 | 0.1563 | 0.131* | |
C28 | 1.1946 (7) | 0.5103 (6) | 0.1360 (3) | 0.0743 (15) | |
H28A | 1.1771 | 0.4955 | 0.0881 | 0.089* | |
C29 | 0.7866 (6) | 0.7618 (5) | −0.0782 (2) | 0.0542 (11) | |
C30 | 0.8508 (7) | 0.8559 (5) | −0.1128 (3) | 0.0655 (14) | |
H30A | 0.8211 | 0.9427 | −0.1128 | 0.079* | |
C31 | 0.9583 (8) | 0.8215 (6) | −0.1473 (3) | 0.0708 (16) | |
H31A | 1.0007 | 0.8854 | −0.1699 | 0.085* | |
C32 | 1.0026 (8) | 0.6954 (6) | −0.1483 (4) | 0.0799 (18) | |
H32A | 1.0762 | 0.6730 | −0.1708 | 0.096* | |
C33 | 0.9384 (9) | 0.6019 (6) | −0.1160 (4) | 0.094 (2) | |
H33A | 0.9669 | 0.5151 | −0.1179 | 0.113* | |
C34 | 0.8332 (8) | 0.6325 (5) | −0.0808 (3) | 0.0759 (16) | |
H34A | 0.7923 | 0.5670 | −0.0584 | 0.091* | |
P1 | 0.40746 (18) | 0.28600 (16) | 0.99063 (8) | 0.0720 (4) | |
F1 | 0.4883 (6) | 0.3998 (5) | 1.0371 (3) | 0.143 (2) | |
F2 | 0.2686 (5) | 0.3755 (6) | 0.9679 (3) | 0.1375 (19) | |
F3 | 0.3617 (8) | 0.2291 (6) | 1.0564 (2) | 0.147 (2) | |
F4 | 0.3258 (7) | 0.1702 (5) | 0.9455 (3) | 0.1329 (19) | |
F5 | 0.5460 (7) | 0.1968 (5) | 1.0122 (3) | 0.142 (2) | |
F6 | 0.4604 (7) | 0.3358 (6) | 0.9245 (3) | 0.151 (2) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Ag1 | 0.0744 (3) | 0.0620 (2) | 0.0589 (2) | 0.0054 (2) | 0.01552 (18) | 0.0024 (2) |
S1 | 0.0532 (7) | 0.0571 (7) | 0.0645 (8) | −0.0050 (5) | 0.0158 (6) | −0.0020 (6) |
S2 | 0.0499 (7) | 0.0826 (9) | 0.0721 (8) | 0.0012 (6) | 0.0185 (6) | 0.0160 (7) |
S3 | 0.0649 (8) | 0.0582 (7) | 0.0519 (7) | 0.0121 (6) | 0.0163 (6) | 0.0036 (5) |
S4 | 0.0703 (8) | 0.0547 (7) | 0.0600 (7) | 0.0078 (6) | 0.0107 (6) | 0.0086 (6) |
C1 | 0.059 (3) | 0.056 (3) | 0.071 (3) | 0.007 (2) | 0.015 (3) | 0.003 (2) |
C2 | 0.054 (3) | 0.054 (3) | 0.059 (3) | 0.004 (2) | 0.006 (2) | 0.004 (2) |
C3 | 0.051 (3) | 0.057 (3) | 0.069 (3) | 0.008 (2) | 0.014 (2) | 0.002 (2) |
C4 | 0.043 (3) | 0.072 (3) | 0.072 (3) | 0.010 (2) | 0.015 (2) | 0.010 (3) |
C5 | 0.068 (4) | 0.088 (4) | 0.066 (3) | −0.004 (3) | 0.020 (3) | 0.014 (3) |
C6 | 0.101 (5) | 0.096 (5) | 0.062 (3) | 0.006 (4) | 0.022 (4) | −0.001 (3) |
C7 | 0.085 (5) | 0.080 (4) | 0.078 (4) | −0.001 (3) | 0.025 (4) | −0.002 (3) |
C8 | 0.075 (4) | 0.084 (4) | 0.079 (4) | −0.006 (3) | 0.025 (3) | −0.001 (3) |
C9 | 0.066 (4) | 0.087 (4) | 0.080 (4) | −0.009 (3) | 0.025 (3) | −0.004 (3) |
C10 | 0.047 (3) | 0.054 (3) | 0.082 (4) | 0.005 (2) | 0.016 (3) | 0.003 (2) |
C11 | 0.054 (3) | 0.045 (2) | 0.062 (3) | 0.0037 (19) | 0.023 (2) | 0.000 (2) |
C12 | 0.063 (4) | 0.083 (4) | 0.084 (4) | −0.004 (3) | 0.028 (3) | 0.010 (3) |
C13 | 0.103 (6) | 0.104 (5) | 0.066 (4) | 0.005 (4) | 0.039 (4) | 0.021 (4) |
C14 | 0.093 (5) | 0.072 (4) | 0.070 (4) | 0.012 (3) | 0.011 (4) | 0.003 (3) |
C15 | 0.063 (4) | 0.081 (4) | 0.077 (4) | 0.010 (3) | 0.012 (3) | 0.000 (3) |
C16 | 0.053 (3) | 0.068 (3) | 0.072 (4) | 0.003 (2) | 0.022 (3) | −0.002 (3) |
C17 | 0.046 (3) | 0.057 (3) | 0.065 (3) | 0.001 (2) | 0.026 (2) | 0.010 (2) |
C22 | 0.068 (4) | 0.063 (3) | 0.117 (5) | 0.010 (3) | 0.040 (4) | 0.008 (3) |
C21 | 0.096 (6) | 0.086 (5) | 0.116 (6) | −0.021 (4) | 0.047 (5) | −0.045 (5) |
C20 | 0.075 (4) | 0.115 (6) | 0.074 (4) | −0.003 (4) | 0.030 (3) | −0.016 (4) |
C19 | 0.064 (3) | 0.085 (4) | 0.062 (3) | 0.005 (3) | 0.021 (3) | 0.002 (3) |
C18 | 0.060 (3) | 0.062 (3) | 0.063 (3) | −0.005 (2) | 0.027 (3) | 0.003 (2) |
C23 | 0.057 (3) | 0.039 (2) | 0.064 (3) | 0.0033 (19) | 0.018 (2) | 0.003 (2) |
C24 | 0.081 (4) | 0.051 (3) | 0.067 (3) | −0.002 (2) | 0.011 (3) | −0.002 (2) |
C25 | 0.108 (6) | 0.062 (3) | 0.080 (4) | −0.014 (4) | −0.011 (4) | 0.002 (3) |
C26 | 0.063 (5) | 0.084 (5) | 0.152 (8) | −0.008 (3) | −0.005 (5) | 0.024 (5) |
C27 | 0.060 (5) | 0.105 (5) | 0.169 (9) | 0.016 (4) | 0.043 (5) | 0.029 (6) |
C28 | 0.076 (4) | 0.074 (4) | 0.080 (4) | 0.010 (3) | 0.032 (3) | 0.012 (3) |
C29 | 0.068 (3) | 0.057 (3) | 0.039 (2) | 0.006 (2) | 0.016 (2) | 0.002 (2) |
C30 | 0.079 (4) | 0.057 (3) | 0.060 (3) | −0.005 (3) | 0.014 (3) | 0.003 (3) |
C31 | 0.083 (4) | 0.075 (4) | 0.062 (3) | −0.011 (3) | 0.033 (3) | 0.003 (3) |
C32 | 0.091 (5) | 0.087 (4) | 0.076 (4) | 0.004 (3) | 0.049 (4) | −0.009 (3) |
C33 | 0.139 (6) | 0.062 (3) | 0.099 (5) | 0.025 (4) | 0.062 (5) | −0.003 (3) |
C34 | 0.104 (5) | 0.053 (3) | 0.083 (4) | 0.008 (3) | 0.047 (4) | 0.008 (3) |
P1 | 0.0735 (10) | 0.0870 (10) | 0.0523 (8) | −0.0103 (8) | 0.0079 (7) | 0.0002 (7) |
F1 | 0.164 (5) | 0.106 (3) | 0.122 (3) | −0.052 (3) | −0.044 (3) | 0.016 (3) |
F2 | 0.093 (3) | 0.172 (5) | 0.133 (4) | 0.041 (3) | −0.003 (3) | −0.037 (4) |
F3 | 0.206 (6) | 0.159 (4) | 0.084 (3) | −0.084 (4) | 0.053 (3) | −0.007 (3) |
F4 | 0.157 (5) | 0.128 (4) | 0.093 (3) | −0.013 (3) | −0.013 (3) | −0.034 (3) |
F5 | 0.141 (5) | 0.162 (5) | 0.107 (3) | 0.049 (3) | −0.003 (3) | 0.026 (3) |
F6 | 0.135 (4) | 0.230 (6) | 0.097 (3) | 0.043 (4) | 0.045 (3) | 0.075 (4) |
Ag1—S4 | 2.6040 (13) | C13—C14 | 1.335 (10) |
Ag1—S2 | 2.6059 (15) | C13—H13A | 0.9300 |
Ag1—S1 | 2.6241 (14) | C14—C15 | 1.373 (9) |
Ag1—S3 | 2.6809 (13) | C14—H14A | 0.9300 |
S1—C11 | 1.788 (6) | C15—C16 | 1.370 (9) |
S1—C4 | 1.827 (5) | C15—H15A | 0.9300 |
S2—C17 | 1.774 (5) | C16—H16A | 0.9300 |
S2—C5 | 1.814 (6) | C17—C18 | 1.385 (7) |
S3—C29 | 1.770 (5) | C17—C22 | 1.394 (8) |
S3—C9 | 1.819 (6) | C22—C21 | 1.396 (11) |
S4—C23 | 1.778 (5) | C22—H22A | 0.9300 |
S4—C10 | 1.821 (5) | C21—C20 | 1.339 (11) |
C1—C10i | 1.497 (6) | C21—H21A | 0.9300 |
C1—C2 | 1.513 (7) | C20—C19 | 1.363 (9) |
C1—H1A | 0.9700 | C20—H20A | 0.9300 |
C1—H1B | 0.9700 | C19—C18 | 1.353 (8) |
C2—C3 | 1.522 (7) | C19—H19A | 0.9300 |
C2—H2A | 0.9700 | C18—H18A | 0.9300 |
C2—H2B | 0.9700 | C23—C24 | 1.381 (7) |
C3—C4 | 1.506 (7) | C23—C28 | 1.387 (7) |
C3—H3A | 0.9700 | C24—C25 | 1.376 (9) |
C3—H3B | 0.9700 | C24—H24A | 0.9300 |
C4—H4A | 0.9700 | C25—C26 | 1.348 (11) |
C4—H4B | 0.9700 | C25—H25A | 0.9300 |
C5—C6ii | 1.483 (8) | C26—C27 | 1.398 (11) |
C5—H5A | 0.9700 | C26—H26A | 0.9300 |
C5—H5B | 0.9700 | C27—C28 | 1.374 (10) |
C6—C5iii | 1.483 (8) | C27—H27A | 0.9300 |
C6—C7 | 1.567 (9) | C28—H28A | 0.9300 |
C6—H6A | 0.9700 | C29—C30 | 1.392 (8) |
C6—H6B | 0.9700 | C29—C34 | 1.397 (8) |
C7—C8 | 1.470 (9) | C30—C31 | 1.382 (8) |
C7—H7A | 0.9700 | C30—H30A | 0.9300 |
C7—H7B | 0.9700 | C31—C32 | 1.356 (8) |
C8—C9 | 1.523 (9) | C31—H31A | 0.9300 |
C8—H8A | 0.9700 | C32—C33 | 1.360 (9) |
C8—H8B | 0.9700 | C32—H32A | 0.9300 |
C9—H9A | 0.9700 | C33—C34 | 1.365 (8) |
C9—H9B | 0.9700 | C33—H33A | 0.9300 |
C10—C1iv | 1.497 (6) | C34—H34A | 0.9300 |
C10—H10A | 0.9700 | P1—F1 | 1.564 (5) |
C10—H10B | 0.9700 | P1—F3 | 1.564 (5) |
C11—C12 | 1.374 (8) | P1—F5 | 1.566 (5) |
C11—C16 | 1.385 (8) | P1—F2 | 1.572 (5) |
C12—C13 | 1.406 (9) | P1—F4 | 1.570 (5) |
C12—H12A | 0.9300 | P1—F6 | 1.578 (5) |
S4—Ag1—S2 | 120.18 (5) | C13—C12—H12A | 120.5 |
S4—Ag1—S1 | 105.66 (4) | C14—C13—C12 | 121.6 (6) |
S2—Ag1—S1 | 120.61 (5) | C14—C13—H13A | 119.2 |
S4—Ag1—S3 | 100.97 (4) | C12—C13—H13A | 119.2 |
S2—Ag1—S3 | 99.81 (5) | C13—C14—C15 | 119.4 (6) |
S1—Ag1—S3 | 106.64 (4) | C13—C14—H14A | 120.3 |
C11—S1—C4 | 101.5 (2) | C15—C14—H14A | 120.3 |
C11—S1—Ag1 | 106.98 (16) | C16—C15—C14 | 120.3 (6) |
C4—S1—Ag1 | 107.22 (17) | C16—C15—H15A | 119.9 |
C17—S2—C5 | 100.1 (3) | C14—C15—H15A | 119.9 |
C17—S2—Ag1 | 110.84 (15) | C15—C16—C11 | 121.0 (5) |
C5—S2—Ag1 | 119.0 (2) | C15—C16—H16A | 119.5 |
C29—S3—C9 | 103.4 (3) | C11—C16—H16A | 119.5 |
C29—S3—Ag1 | 101.39 (17) | C18—C17—C22 | 118.0 (5) |
C9—S3—Ag1 | 109.7 (2) | C18—C17—S2 | 122.6 (4) |
C23—S4—C10 | 103.3 (2) | C22—C17—S2 | 119.4 (4) |
C23—S4—Ag1 | 111.77 (15) | C21—C22—C17 | 118.9 (6) |
C10—S4—Ag1 | 109.53 (16) | C21—C22—H22A | 120.5 |
C10i—C1—C2 | 115.0 (4) | C17—C22—H22A | 120.5 |
C10i—C1—H1A | 108.5 | C20—C21—C22 | 121.4 (7) |
C2—C1—H1A | 108.5 | C20—C21—H21A | 119.3 |
C10i—C1—H1B | 108.5 | C22—C21—H21A | 119.3 |
C2—C1—H1B | 108.5 | C21—C20—C19 | 119.7 (7) |
H1A—C1—H1B | 107.5 | C21—C20—H20A | 120.2 |
C1—C2—C3 | 110.5 (4) | C19—C20—H20A | 120.2 |
C1—C2—H2A | 109.6 | C18—C19—C20 | 120.9 (6) |
C3—C2—H2A | 109.6 | C18—C19—H19A | 119.6 |
C1—C2—H2B | 109.6 | C20—C19—H19A | 119.6 |
C3—C2—H2B | 109.6 | C19—C18—C17 | 121.1 (5) |
H2A—C2—H2B | 108.1 | C19—C18—H18A | 119.4 |
C4—C3—C2 | 113.9 (4) | C17—C18—H18A | 119.4 |
C4—C3—H3A | 108.8 | C24—C23—C28 | 119.7 (5) |
C2—C3—H3A | 108.8 | C24—C23—S4 | 122.7 (4) |
C4—C3—H3B | 108.8 | C28—C23—S4 | 117.6 (4) |
C2—C3—H3B | 108.8 | C23—C24—C25 | 119.8 (6) |
H3A—C3—H3B | 107.7 | C23—C24—H24A | 120.1 |
C3—C4—S1 | 114.5 (3) | C25—C24—H24A | 120.1 |
C3—C4—H4A | 108.6 | C26—C25—C24 | 122.0 (7) |
S1—C4—H4A | 108.6 | C26—C25—H25A | 119.0 |
C3—C4—H4B | 108.6 | C24—C25—H25A | 119.0 |
S1—C4—H4B | 108.6 | C25—C26—C27 | 118.0 (7) |
H4A—C4—H4B | 107.6 | C25—C26—H26A | 121.0 |
C6ii—C5—S2 | 115.8 (4) | C27—C26—H26A | 121.0 |
C6ii—C5—H5A | 108.3 | C28—C27—C26 | 121.6 (7) |
S2—C5—H5A | 108.3 | C28—C27—H27A | 119.2 |
C6ii—C5—H5B | 108.3 | C26—C27—H27A | 119.2 |
S2—C5—H5B | 108.3 | C27—C28—C23 | 118.9 (6) |
H5A—C5—H5B | 107.4 | C27—C28—H28A | 120.6 |
C5iii—C6—C7 | 111.2 (5) | C23—C28—H28A | 120.6 |
C5iii—C6—H6A | 109.4 | C30—C29—C34 | 117.5 (5) |
C7—C6—H6A | 109.4 | C30—C29—S3 | 117.6 (4) |
C5iii—C6—H6B | 109.4 | C34—C29—S3 | 124.8 (4) |
C7—C6—H6B | 109.4 | C31—C30—C29 | 120.6 (5) |
H6A—C6—H6B | 108.0 | C31—C30—H30A | 119.7 |
C8—C7—C6 | 112.0 (5) | C29—C30—H30A | 119.7 |
C8—C7—H7A | 109.2 | C32—C31—C30 | 120.6 (5) |
C6—C7—H7A | 109.2 | C32—C31—H31A | 119.7 |
C8—C7—H7B | 109.2 | C30—C31—H31A | 119.7 |
C6—C7—H7B | 109.2 | C31—C32—C33 | 119.4 (6) |
H7A—C7—H7B | 107.9 | C31—C32—H32A | 120.3 |
C7—C8—C9 | 115.2 (5) | C33—C32—H32A | 120.3 |
C7—C8—H8A | 108.5 | C34—C33—C32 | 121.6 (5) |
C9—C8—H8A | 108.5 | C34—C33—H33A | 119.2 |
C7—C8—H8B | 108.5 | C32—C33—H33A | 119.2 |
C9—C8—H8B | 108.5 | C33—C34—C29 | 120.3 (5) |
H8A—C8—H8B | 107.5 | C33—C34—H34A | 119.9 |
C8—C9—S3 | 112.0 (4) | C29—C34—H34A | 119.9 |
C8—C9—H9A | 109.2 | F1—P1—F3 | 89.0 (3) |
S3—C9—H9A | 109.2 | F1—P1—F5 | 90.7 (3) |
C8—C9—H9B | 109.2 | F3—P1—F5 | 85.9 (4) |
S3—C9—H9B | 109.2 | F1—P1—F2 | 89.6 (3) |
H9A—C9—H9B | 107.9 | F3—P1—F2 | 94.8 (4) |
C1iv—C10—S4 | 112.3 (4) | F5—P1—F2 | 179.2 (3) |
C1iv—C10—H10A | 109.1 | F1—P1—F4 | 178.7 (3) |
S4—C10—H10A | 109.1 | F3—P1—F4 | 89.8 (3) |
C1iv—C10—H10B | 109.1 | F5—P1—F4 | 89.0 (3) |
S4—C10—H10B | 109.1 | F2—P1—F4 | 90.7 (3) |
H10A—C10—H10B | 107.9 | F1—P1—F6 | 92.2 (3) |
C12—C11—C16 | 118.6 (5) | F3—P1—F6 | 176.4 (4) |
C12—C11—S1 | 119.8 (4) | F5—P1—F6 | 90.7 (3) |
C16—C11—S1 | 121.6 (4) | F2—P1—F6 | 88.6 (3) |
C11—C12—C13 | 119.1 (6) | F4—P1—F6 | 89.0 (4) |
C11—C12—H12A | 120.5 |
Symmetry codes: (i) x, y+1, z; (ii) x+1, y, z; (iii) x−1, y, z; (iv) x, y−1, z. |