Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536803022463/cf6286sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536803022463/cf6286Isup2.hkl |
CCDC reference: 226973
Data collection: SMART (Siemens, 1994); cell refinement: SMART; data reduction: SAINT (Siemens, 1994); program(s) used to solve structure: SHELXS97 (Sheldrick 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEP-3 for Windows (Farrugia, 1997); software used to prepare material for publication: WinGX (Version 1.64; Farrugia, 1999).
C18F15OP | F(000) = 2128 |
Mr = 548.15 | Dx = 2.042 Mg m−3 |
Monoclinic, P21/c | Mo Kα radiation, λ = 0.71073 Å |
a = 9.562 (1) Å | Cell parameters from 7905 reflections |
b = 20.489 (1) Å | θ = 2–26° |
c = 18.303 (1) Å | µ = 0.32 mm−1 |
β = 95.95 (1)° | T = 83 K |
V = 3566.5 (5) Å3 | Needle, white |
Z = 8 | 0.46 × 0.18 × 0.16 mm |
Siemens SMART CCD diffractometer | 7300 independent reflections |
Radiation source: fine-focus sealed tube | 5418 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.034 |
ω scans | θmax = 26.4°, θmin = 1.5° |
Absorption correction: multi-scan (Blessing, 1995) | h = −11→11 |
Tmin = 0.867, Tmax = 0.951 | k = 0→25 |
14186 measured reflections | l = −22→22 |
Refinement on F2 | 0 restraints |
Least-squares matrix: full | Primary atom site location: structure-invariant direct methods |
R[F2 > 2σ(F2)] = 0.040 | Secondary atom site location: difference Fourier map |
wR(F2) = 0.096 | w = 1/[σ2(Fo2) + (0.0407P)2 + 2.4099P] where P = (Fo2 + 2Fc2)/3 |
S = 1.03 | (Δ/σ)max = 0.001 |
7300 reflections | Δρmax = 0.35 e Å−3 |
631 parameters | Δρmin = −0.36 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. |
x | y | z | Uiso*/Ueq | ||
P1 | 0.23271 (7) | 0.69048 (3) | 0.91508 (3) | 0.01770 (14) | |
O1 | 0.27916 (18) | 0.75340 (8) | 0.94725 (9) | 0.0235 (4) | |
F12 | −0.08513 (14) | 0.63627 (7) | 0.90415 (8) | 0.0251 (3) | |
F13 | −0.20422 (15) | 0.57365 (7) | 1.00707 (9) | 0.0322 (4) | |
F14 | −0.06004 (18) | 0.55080 (8) | 1.14085 (9) | 0.0375 (4) | |
F15 | 0.21150 (17) | 0.59042 (8) | 1.16792 (8) | 0.0340 (4) | |
F16 | 0.34134 (15) | 0.64740 (7) | 1.06102 (8) | 0.0275 (3) | |
F22 | 0.12257 (17) | 0.81180 (7) | 0.82694 (9) | 0.0314 (4) | |
F23 | −0.04231 (18) | 0.81450 (9) | 0.69968 (10) | 0.0441 (5) | |
F24 | −0.13147 (17) | 0.70183 (10) | 0.63239 (9) | 0.0448 (5) | |
F25 | −0.05302 (17) | 0.58501 (8) | 0.69331 (9) | 0.0403 (4) | |
F26 | 0.11380 (15) | 0.58111 (7) | 0.82116 (8) | 0.0259 (3) | |
F32 | 0.31904 (16) | 0.54072 (7) | 0.94494 (9) | 0.0300 (4) | |
F33 | 0.54156 (17) | 0.47978 (7) | 0.90027 (9) | 0.0371 (4) | |
F34 | 0.72242 (15) | 0.54452 (8) | 0.82097 (9) | 0.0334 (4) | |
F35 | 0.67566 (16) | 0.67142 (8) | 0.78450 (9) | 0.0336 (4) | |
F36 | 0.45268 (15) | 0.73412 (7) | 0.82952 (8) | 0.0258 (3) | |
C11 | 0.1359 (3) | 0.64334 (11) | 0.97756 (13) | 0.0187 (5) | |
C12 | −0.0040 (3) | 0.62411 (12) | 0.96733 (14) | 0.0207 (5) | |
C13 | −0.0693 (3) | 0.59247 (12) | 1.02085 (15) | 0.0245 (6) | |
C14 | 0.0031 (3) | 0.58050 (12) | 1.08850 (14) | 0.0255 (6) | |
C15 | 0.1413 (3) | 0.60008 (12) | 1.10181 (14) | 0.0255 (6) | |
C16 | 0.2054 (3) | 0.63048 (12) | 1.04686 (14) | 0.0215 (5) | |
C21 | 0.1221 (2) | 0.69569 (12) | 0.82870 (13) | 0.0194 (5) | |
C22 | 0.0816 (3) | 0.75479 (13) | 0.79595 (14) | 0.0241 (6) | |
C23 | −0.0041 (3) | 0.75689 (14) | 0.72984 (15) | 0.0299 (6) | |
C24 | −0.0490 (3) | 0.69967 (15) | 0.69624 (14) | 0.0307 (7) | |
C25 | −0.0096 (3) | 0.64023 (14) | 0.72671 (14) | 0.0274 (6) | |
C26 | 0.0764 (2) | 0.63927 (12) | 0.79168 (14) | 0.0213 (5) | |
C31 | 0.3790 (2) | 0.64076 (12) | 0.89025 (13) | 0.0192 (5) | |
C32 | 0.4050 (3) | 0.57518 (12) | 0.90656 (14) | 0.0227 (5) | |
C33 | 0.5196 (3) | 0.54295 (12) | 0.88333 (15) | 0.0263 (6) | |
C34 | 0.6110 (3) | 0.57556 (13) | 0.84291 (14) | 0.0244 (6) | |
C35 | 0.5875 (3) | 0.63994 (13) | 0.82485 (14) | 0.0239 (6) | |
C36 | 0.4730 (3) | 0.67152 (12) | 0.84864 (13) | 0.0212 (5) | |
P2 | 0.35787 (6) | 0.61940 (3) | 0.63562 (3) | 0.01802 (14) | |
O2 | 0.31295 (18) | 0.64998 (8) | 0.70178 (9) | 0.0235 (4) | |
F42 | 0.20850 (14) | 0.51079 (7) | 0.69146 (8) | 0.0282 (3) | |
F43 | 0.30154 (16) | 0.39320 (7) | 0.74170 (9) | 0.0335 (4) | |
F44 | 0.57237 (17) | 0.35809 (7) | 0.73119 (9) | 0.0329 (4) | |
F45 | 0.75148 (15) | 0.44183 (7) | 0.67415 (8) | 0.0303 (4) | |
F46 | 0.66368 (14) | 0.55963 (7) | 0.62693 (8) | 0.0259 (3) | |
F52 | 0.26525 (15) | 0.49966 (7) | 0.52869 (8) | 0.0250 (3) | |
F53 | 0.06359 (15) | 0.50076 (7) | 0.41726 (8) | 0.0259 (3) | |
F54 | −0.09423 (15) | 0.60924 (8) | 0.38647 (8) | 0.0321 (4) | |
F55 | −0.04669 (16) | 0.71843 (7) | 0.46979 (9) | 0.0311 (4) | |
F56 | 0.15452 (15) | 0.71893 (7) | 0.58287 (8) | 0.0239 (3) | |
F62 | 0.48754 (16) | 0.75316 (7) | 0.67759 (8) | 0.0278 (3) | |
F63 | 0.64005 (16) | 0.82941 (7) | 0.59837 (8) | 0.0292 (4) | |
F64 | 0.71166 (15) | 0.78893 (7) | 0.46668 (8) | 0.0273 (3) | |
F65 | 0.63732 (15) | 0.66753 (7) | 0.41587 (8) | 0.0276 (3) | |
F66 | 0.48424 (14) | 0.58921 (7) | 0.49495 (8) | 0.0231 (3) | |
C41 | 0.4315 (3) | 0.53937 (11) | 0.65708 (13) | 0.0192 (5) | |
C42 | 0.3442 (3) | 0.49489 (13) | 0.68782 (14) | 0.0230 (5) | |
C43 | 0.3889 (3) | 0.43455 (12) | 0.71302 (14) | 0.0238 (6) | |
C44 | 0.5271 (3) | 0.41673 (12) | 0.70806 (14) | 0.0240 (6) | |
C45 | 0.6178 (3) | 0.45921 (12) | 0.67844 (13) | 0.0217 (5) | |
C46 | 0.5702 (3) | 0.51967 (12) | 0.65374 (13) | 0.0198 (5) | |
C51 | 0.2171 (2) | 0.60933 (12) | 0.56150 (13) | 0.0191 (5) | |
C52 | 0.1903 (2) | 0.55510 (11) | 0.51676 (14) | 0.0203 (5) | |
C53 | 0.0867 (3) | 0.55441 (12) | 0.45831 (13) | 0.0214 (5) | |
C54 | 0.0055 (3) | 0.60920 (13) | 0.44328 (14) | 0.0240 (6) | |
C55 | 0.0285 (2) | 0.66413 (12) | 0.48607 (14) | 0.0219 (5) | |
C56 | 0.1329 (3) | 0.66379 (12) | 0.54381 (13) | 0.0201 (5) | |
C61 | 0.4804 (2) | 0.66790 (12) | 0.58920 (13) | 0.0181 (5) | |
C62 | 0.5223 (2) | 0.73001 (12) | 0.61365 (13) | 0.0197 (5) | |
C63 | 0.6007 (3) | 0.77026 (11) | 0.57303 (14) | 0.0217 (5) | |
C64 | 0.6382 (2) | 0.74960 (12) | 0.50661 (14) | 0.0211 (5) | |
C65 | 0.5999 (2) | 0.68779 (12) | 0.48056 (13) | 0.0212 (5) | |
C66 | 0.5225 (2) | 0.64887 (11) | 0.52178 (13) | 0.0190 (5) |
U11 | U22 | U33 | U12 | U13 | U23 | |
P1 | 0.0180 (3) | 0.0169 (3) | 0.0180 (3) | −0.0011 (2) | 0.0013 (2) | 0.0001 (3) |
O1 | 0.0245 (9) | 0.0220 (9) | 0.0239 (10) | −0.0031 (7) | 0.0021 (7) | −0.0026 (7) |
F12 | 0.0200 (7) | 0.0314 (8) | 0.0233 (8) | −0.0030 (6) | −0.0003 (6) | 0.0018 (6) |
F13 | 0.0254 (8) | 0.0339 (9) | 0.0379 (9) | −0.0107 (7) | 0.0068 (7) | 0.0042 (7) |
F14 | 0.0487 (10) | 0.0336 (9) | 0.0318 (9) | −0.0098 (8) | 0.0121 (8) | 0.0101 (7) |
F15 | 0.0434 (10) | 0.0362 (9) | 0.0213 (8) | 0.0000 (7) | −0.0022 (7) | 0.0082 (7) |
F16 | 0.0239 (8) | 0.0318 (8) | 0.0253 (8) | −0.0044 (6) | −0.0048 (6) | 0.0029 (7) |
F22 | 0.0371 (9) | 0.0198 (8) | 0.0375 (9) | −0.0004 (7) | 0.0041 (7) | 0.0048 (7) |
F23 | 0.0422 (10) | 0.0503 (11) | 0.0394 (10) | 0.0131 (8) | 0.0019 (8) | 0.0237 (8) |
F24 | 0.0282 (9) | 0.0813 (14) | 0.0230 (9) | 0.0127 (9) | −0.0065 (7) | 0.0013 (9) |
F25 | 0.0304 (9) | 0.0525 (11) | 0.0360 (10) | 0.0017 (8) | −0.0061 (7) | −0.0241 (8) |
F26 | 0.0266 (8) | 0.0208 (7) | 0.0293 (8) | 0.0003 (6) | −0.0015 (6) | −0.0048 (6) |
F32 | 0.0332 (8) | 0.0213 (8) | 0.0367 (9) | −0.0003 (7) | 0.0091 (7) | 0.0056 (7) |
F33 | 0.0415 (10) | 0.0227 (8) | 0.0473 (10) | 0.0110 (7) | 0.0047 (8) | 0.0025 (7) |
F34 | 0.0240 (8) | 0.0384 (9) | 0.0378 (9) | 0.0083 (7) | 0.0029 (7) | −0.0089 (7) |
F35 | 0.0276 (8) | 0.0393 (9) | 0.0360 (9) | 0.0000 (7) | 0.0139 (7) | 0.0015 (7) |
F36 | 0.0285 (8) | 0.0219 (8) | 0.0281 (8) | 0.0005 (6) | 0.0076 (6) | 0.0033 (6) |
C11 | 0.0226 (12) | 0.0151 (12) | 0.0188 (13) | 0.0002 (10) | 0.0037 (10) | −0.0002 (10) |
C12 | 0.0236 (13) | 0.0188 (12) | 0.0195 (13) | 0.0007 (10) | 0.0010 (10) | −0.0014 (10) |
C13 | 0.0220 (13) | 0.0215 (13) | 0.0304 (15) | −0.0038 (10) | 0.0046 (11) | −0.0015 (11) |
C14 | 0.0371 (15) | 0.0179 (13) | 0.0229 (14) | −0.0024 (11) | 0.0098 (12) | 0.0027 (11) |
C15 | 0.0357 (15) | 0.0210 (13) | 0.0188 (13) | 0.0008 (11) | −0.0016 (11) | 0.0027 (11) |
C16 | 0.0231 (13) | 0.0182 (12) | 0.0229 (13) | −0.0018 (10) | 0.0013 (10) | −0.0016 (10) |
C21 | 0.0154 (12) | 0.0231 (13) | 0.0198 (13) | −0.0002 (10) | 0.0025 (10) | −0.0015 (10) |
C22 | 0.0220 (13) | 0.0258 (14) | 0.0256 (14) | 0.0015 (11) | 0.0081 (11) | 0.0044 (11) |
C23 | 0.0243 (14) | 0.0399 (17) | 0.0265 (15) | 0.0098 (12) | 0.0073 (11) | 0.0141 (13) |
C24 | 0.0169 (13) | 0.061 (2) | 0.0143 (13) | 0.0082 (13) | 0.0007 (10) | 0.0009 (13) |
C25 | 0.0178 (13) | 0.0417 (17) | 0.0230 (14) | 0.0022 (12) | 0.0034 (10) | −0.0103 (12) |
C26 | 0.0163 (12) | 0.0247 (13) | 0.0233 (13) | 0.0022 (10) | 0.0040 (10) | −0.0017 (11) |
C31 | 0.0184 (12) | 0.0199 (12) | 0.0187 (12) | −0.0004 (10) | −0.0012 (10) | −0.0017 (10) |
C32 | 0.0255 (13) | 0.0223 (13) | 0.0203 (13) | −0.0016 (10) | 0.0016 (11) | −0.0006 (10) |
C33 | 0.0293 (14) | 0.0198 (13) | 0.0283 (15) | 0.0053 (11) | −0.0046 (11) | 0.0010 (11) |
C34 | 0.0196 (13) | 0.0300 (14) | 0.0230 (14) | 0.0057 (11) | −0.0014 (10) | −0.0080 (11) |
C35 | 0.0202 (13) | 0.0310 (14) | 0.0203 (13) | −0.0023 (11) | 0.0014 (10) | −0.0018 (11) |
C36 | 0.0240 (13) | 0.0204 (12) | 0.0185 (13) | 0.0002 (10) | −0.0006 (10) | 0.0004 (10) |
P2 | 0.0169 (3) | 0.0193 (3) | 0.0179 (3) | 0.0000 (2) | 0.0021 (2) | −0.0002 (3) |
O2 | 0.0235 (9) | 0.0264 (9) | 0.0209 (9) | 0.0009 (8) | 0.0033 (7) | −0.0027 (8) |
F42 | 0.0189 (7) | 0.0312 (8) | 0.0347 (9) | −0.0020 (6) | 0.0038 (6) | 0.0049 (7) |
F43 | 0.0311 (9) | 0.0316 (9) | 0.0373 (9) | −0.0090 (7) | 0.0012 (7) | 0.0123 (7) |
F44 | 0.0397 (9) | 0.0214 (8) | 0.0365 (9) | 0.0012 (7) | −0.0019 (7) | 0.0076 (7) |
F45 | 0.0264 (8) | 0.0297 (8) | 0.0355 (9) | 0.0106 (7) | 0.0070 (7) | 0.0073 (7) |
F46 | 0.0196 (7) | 0.0256 (8) | 0.0334 (9) | 0.0011 (6) | 0.0068 (6) | 0.0088 (6) |
F52 | 0.0266 (8) | 0.0204 (7) | 0.0271 (8) | 0.0042 (6) | −0.0011 (6) | −0.0034 (6) |
F53 | 0.0276 (8) | 0.0258 (8) | 0.0238 (8) | −0.0077 (6) | 0.0011 (6) | −0.0059 (6) |
F54 | 0.0245 (8) | 0.0396 (9) | 0.0299 (9) | −0.0032 (7) | −0.0086 (7) | 0.0001 (7) |
F55 | 0.0273 (8) | 0.0276 (8) | 0.0368 (9) | 0.0084 (7) | −0.0048 (7) | 0.0027 (7) |
F56 | 0.0270 (8) | 0.0205 (7) | 0.0241 (8) | 0.0034 (6) | 0.0029 (6) | −0.0025 (6) |
F62 | 0.0365 (9) | 0.0237 (8) | 0.0241 (8) | −0.0030 (7) | 0.0074 (7) | −0.0069 (6) |
F63 | 0.0330 (9) | 0.0191 (7) | 0.0356 (9) | −0.0048 (6) | 0.0036 (7) | −0.0033 (7) |
F64 | 0.0232 (8) | 0.0271 (8) | 0.0322 (9) | −0.0024 (6) | 0.0058 (6) | 0.0079 (7) |
F65 | 0.0291 (8) | 0.0344 (9) | 0.0210 (8) | −0.0007 (7) | 0.0100 (6) | −0.0019 (7) |
F66 | 0.0245 (7) | 0.0218 (7) | 0.0237 (8) | −0.0018 (6) | 0.0053 (6) | −0.0059 (6) |
C41 | 0.0221 (12) | 0.0195 (12) | 0.0156 (12) | −0.0004 (10) | 0.0006 (10) | −0.0011 (10) |
C42 | 0.0205 (13) | 0.0272 (14) | 0.0206 (13) | −0.0028 (11) | −0.0007 (10) | −0.0007 (11) |
C43 | 0.0281 (14) | 0.0230 (13) | 0.0198 (13) | −0.0087 (11) | 0.0004 (11) | 0.0031 (10) |
C44 | 0.0332 (14) | 0.0182 (13) | 0.0193 (13) | 0.0017 (11) | −0.0034 (11) | 0.0018 (10) |
C45 | 0.0222 (13) | 0.0235 (13) | 0.0191 (13) | 0.0022 (10) | 0.0002 (10) | −0.0016 (10) |
C46 | 0.0215 (13) | 0.0215 (13) | 0.0163 (12) | −0.0022 (10) | 0.0017 (10) | −0.0008 (10) |
C51 | 0.0170 (12) | 0.0228 (13) | 0.0178 (12) | −0.0013 (10) | 0.0039 (10) | 0.0002 (10) |
C52 | 0.0186 (12) | 0.0186 (12) | 0.0243 (14) | 0.0003 (10) | 0.0054 (10) | 0.0009 (10) |
C53 | 0.0209 (12) | 0.0245 (13) | 0.0196 (13) | −0.0063 (10) | 0.0069 (10) | −0.0017 (11) |
C54 | 0.0167 (12) | 0.0343 (15) | 0.0206 (13) | −0.0045 (11) | 0.0003 (10) | 0.0017 (11) |
C55 | 0.0164 (12) | 0.0247 (13) | 0.0248 (14) | 0.0039 (10) | 0.0029 (10) | 0.0033 (11) |
C56 | 0.0204 (12) | 0.0191 (12) | 0.0213 (13) | −0.0011 (10) | 0.0057 (10) | −0.0004 (10) |
C61 | 0.0156 (12) | 0.0206 (12) | 0.0179 (12) | 0.0027 (9) | 0.0001 (9) | 0.0005 (10) |
C62 | 0.0180 (12) | 0.0220 (13) | 0.0189 (13) | 0.0042 (10) | 0.0015 (10) | −0.0020 (10) |
C63 | 0.0205 (13) | 0.0165 (12) | 0.0274 (14) | 0.0024 (10) | −0.0016 (10) | −0.0004 (11) |
C64 | 0.0146 (12) | 0.0227 (13) | 0.0259 (14) | 0.0010 (10) | 0.0016 (10) | 0.0089 (11) |
C65 | 0.0174 (12) | 0.0283 (14) | 0.0181 (13) | 0.0046 (10) | 0.0022 (10) | 0.0016 (11) |
C66 | 0.0172 (12) | 0.0182 (12) | 0.0209 (13) | 0.0022 (10) | −0.0013 (10) | −0.0015 (10) |
P1—O1 | 1.4670 (17) | P2—O2 | 1.4667 (18) |
P1—C21 | 1.812 (2) | P2—C41 | 1.811 (2) |
P1—C11 | 1.821 (2) | P2—C61 | 1.813 (3) |
P1—C31 | 1.826 (3) | P2—C51 | 1.821 (2) |
F12—C12 | 1.347 (3) | F42—C42 | 1.346 (3) |
F13—C13 | 1.345 (3) | F43—C43 | 1.335 (3) |
F14—C14 | 1.332 (3) | F44—C44 | 1.331 (3) |
F15—C15 | 1.336 (3) | F45—C45 | 1.337 (3) |
F16—C16 | 1.344 (3) | F46—C46 | 1.342 (3) |
F22—C22 | 1.339 (3) | F52—C52 | 1.349 (3) |
F23—C23 | 1.338 (3) | F53—C53 | 1.337 (3) |
F24—C24 | 1.341 (3) | F54—C54 | 1.336 (3) |
F25—C25 | 1.332 (3) | F55—C55 | 1.341 (3) |
F26—C26 | 1.341 (3) | F56—C56 | 1.342 (3) |
F32—C32 | 1.337 (3) | F62—C62 | 1.336 (3) |
F33—C33 | 1.342 (3) | F63—C63 | 1.338 (3) |
F34—C34 | 1.337 (3) | F64—C64 | 1.335 (3) |
F35—C35 | 1.342 (3) | F65—C65 | 1.338 (3) |
F36—C36 | 1.338 (3) | F66—C66 | 1.353 (3) |
C11—C12 | 1.389 (3) | C41—C42 | 1.393 (3) |
C11—C16 | 1.395 (3) | C41—C46 | 1.394 (3) |
C12—C13 | 1.377 (4) | C42—C43 | 1.372 (4) |
C13—C14 | 1.377 (4) | C43—C44 | 1.383 (4) |
C14—C15 | 1.379 (4) | C44—C45 | 1.378 (4) |
C15—C16 | 1.379 (4) | C45—C46 | 1.380 (3) |
C21—C26 | 1.387 (3) | C51—C52 | 1.388 (3) |
C21—C22 | 1.388 (3) | C51—C56 | 1.394 (3) |
C22—C23 | 1.390 (4) | C52—C53 | 1.381 (3) |
C23—C24 | 1.372 (4) | C53—C54 | 1.376 (4) |
C24—C25 | 1.376 (4) | C54—C55 | 1.376 (4) |
C25—C26 | 1.374 (4) | C55—C56 | 1.377 (3) |
C31—C36 | 1.388 (3) | C61—C66 | 1.393 (3) |
C31—C32 | 1.393 (3) | C61—C62 | 1.394 (3) |
C32—C33 | 1.383 (4) | C62—C63 | 1.382 (3) |
C33—C34 | 1.376 (4) | C63—C64 | 1.370 (4) |
C34—C35 | 1.373 (4) | C64—C65 | 1.389 (4) |
C35—C36 | 1.380 (3) | C65—C66 | 1.367 (3) |
O1—P1—C21 | 115.06 (11) | O2—P2—C41 | 110.37 (11) |
O1—P1—C11 | 111.50 (11) | O2—P2—C61 | 114.30 (11) |
C21—P1—C11 | 106.87 (11) | C41—P2—C61 | 110.01 (11) |
O1—P1—C31 | 112.48 (11) | O2—P2—C51 | 113.97 (11) |
C21—P1—C31 | 102.05 (11) | C41—P2—C51 | 107.43 (11) |
C11—P1—C31 | 108.23 (11) | C61—P2—C51 | 100.18 (11) |
C12—C11—C16 | 115.5 (2) | C42—C41—C46 | 116.1 (2) |
C12—C11—P1 | 127.67 (19) | C42—C41—P2 | 116.37 (18) |
C16—C11—P1 | 116.46 (18) | C46—C41—P2 | 127.08 (19) |
F12—C12—C13 | 115.8 (2) | F42—C42—C43 | 118.0 (2) |
F12—C12—C11 | 121.6 (2) | F42—C42—C41 | 118.9 (2) |
C13—C12—C11 | 122.6 (2) | C43—C42—C41 | 123.1 (2) |
F13—C13—C14 | 120.1 (2) | F43—C43—C42 | 121.2 (2) |
F13—C13—C12 | 119.9 (2) | F43—C43—C44 | 120.0 (2) |
C14—C13—C12 | 120.0 (2) | C42—C43—C44 | 118.8 (2) |
F14—C14—C13 | 120.3 (2) | F44—C44—C45 | 119.9 (2) |
F14—C14—C15 | 120.3 (2) | F44—C44—C43 | 119.9 (2) |
C13—C14—C15 | 119.4 (2) | C45—C44—C43 | 120.2 (2) |
F15—C15—C14 | 119.9 (2) | F45—C45—C44 | 119.9 (2) |
F15—C15—C16 | 120.5 (2) | F45—C45—C46 | 120.3 (2) |
C14—C15—C16 | 119.5 (2) | C44—C45—C46 | 119.8 (2) |
F16—C16—C15 | 118.0 (2) | F46—C46—C45 | 117.3 (2) |
F16—C16—C11 | 119.1 (2) | F46—C46—C41 | 120.8 (2) |
C15—C16—C11 | 122.8 (2) | C45—C46—C41 | 121.9 (2) |
C26—C21—C22 | 117.1 (2) | C52—C51—C56 | 115.9 (2) |
C26—C21—P1 | 120.19 (19) | C52—C51—P2 | 127.36 (19) |
C22—C21—P1 | 122.66 (19) | C56—C51—P2 | 116.53 (18) |
F22—C22—C21 | 121.4 (2) | F52—C52—C53 | 116.3 (2) |
F22—C22—C23 | 117.5 (2) | F52—C52—C51 | 121.1 (2) |
C21—C22—C23 | 121.1 (2) | C53—C52—C51 | 122.6 (2) |
F23—C23—C24 | 120.6 (2) | F53—C53—C54 | 120.1 (2) |
F23—C23—C22 | 119.9 (3) | F53—C53—C52 | 120.5 (2) |
C24—C23—C22 | 119.5 (2) | C54—C53—C52 | 119.4 (2) |
F24—C24—C23 | 119.4 (3) | F54—C54—C55 | 120.1 (2) |
F24—C24—C25 | 119.6 (3) | F54—C54—C53 | 119.9 (2) |
C23—C24—C25 | 121.0 (2) | C55—C54—C53 | 120.0 (2) |
F25—C25—C26 | 121.0 (2) | F55—C55—C54 | 120.1 (2) |
F25—C25—C24 | 120.4 (2) | F55—C55—C56 | 120.3 (2) |
C26—C25—C24 | 118.5 (2) | C54—C55—C56 | 119.5 (2) |
F26—C26—C25 | 118.1 (2) | F56—C56—C55 | 117.7 (2) |
F26—C26—C21 | 119.1 (2) | F56—C56—C51 | 119.8 (2) |
C25—C26—C21 | 122.7 (2) | C55—C56—C51 | 122.5 (2) |
C36—C31—C32 | 116.3 (2) | C66—C61—C62 | 116.1 (2) |
C36—C31—P1 | 116.08 (18) | C66—C61—P2 | 121.45 (18) |
C32—C31—P1 | 127.55 (19) | C62—C61—P2 | 121.87 (18) |
F32—C32—C33 | 117.3 (2) | F62—C62—C63 | 117.2 (2) |
F32—C32—C31 | 121.0 (2) | F62—C62—C61 | 121.1 (2) |
C33—C32—C31 | 121.6 (2) | C63—C62—C61 | 121.7 (2) |
F33—C33—C34 | 120.0 (2) | F63—C63—C64 | 119.8 (2) |
F33—C33—C32 | 119.9 (2) | F63—C63—C62 | 120.2 (2) |
C34—C33—C32 | 120.1 (2) | C64—C63—C62 | 120.0 (2) |
F34—C34—C35 | 120.0 (2) | F64—C64—C63 | 120.0 (2) |
F34—C34—C33 | 120.1 (2) | F64—C64—C65 | 119.8 (2) |
C35—C34—C33 | 119.9 (2) | C63—C64—C65 | 120.1 (2) |
F35—C35—C34 | 119.8 (2) | F65—C65—C66 | 121.1 (2) |
F35—C35—C36 | 120.8 (2) | F65—C65—C64 | 120.1 (2) |
C34—C35—C36 | 119.3 (2) | C66—C65—C64 | 118.8 (2) |
F36—C36—C35 | 117.7 (2) | F66—C66—C65 | 117.9 (2) |
F36—C36—C31 | 119.6 (2) | F66—C66—C61 | 118.8 (2) |
C35—C36—C31 | 122.7 (2) | C65—C66—C61 | 123.3 (2) |