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In the structure of the title compound, [Rh2(C7F7S)2(C8H12)2], important geometric parameters are Rh...Rh = 2.9595 (3) Å, mean Rh—S = 2.3949 (8) Å, mean S—C = 1.764 (3) Å and mean S—Rh—S = 87.37 (3)°. The S—Rh—S planes inter­sect at an angle of 117.4 (3)°.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805031235/sg6034sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805031235/sg6034Isup2.hkl
Contains datablock I

CCDC reference: 289881

Key indicators

  • Single-crystal X-ray study
  • T = 193 K
  • Mean [sigma](C-C) = 0.005 Å
  • R factor = 0.022
  • wR factor = 0.052
  • Data-to-parameter ratio = 10.2

checkCIF/PLATON results

No syntax errors found



Alert level A PLAT027_ALERT_3_A _diffrn_reflns_theta_full (too) Low ............ 23.25 Deg.
Author Response: Data were truncated during integration to include strongest reflection data only

Alert level B THETM01_ALERT_3_B The value of sine(theta_max)/wavelength is less than 0.575 Calculated sin(theta_max)/wavelength = 0.5554 PLAT023_ALERT_3_B Resolution (too) Low [sin(th)/Lambda < 0.6]..... 23.25 Deg. PLAT220_ALERT_2_B Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.52 Ratio PLAT411_ALERT_2_B Short Inter H...H Contact H2A .. H2A .. 2.04 Ang.
Alert level C ABSTY02_ALERT_1_C An _exptl_absorpt_correction_type has been given without a literature citation. This should be contained in the _exptl_absorpt_process_details field. Absorption correction given as empirical PLAT125_ALERT_4_C No _symmetry_space_group_name_Hall Given ....... ? PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Rh1 - S1 .. 6.41 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Rh2 - S1 .. 5.37 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Rh2 - S2 .. 5.20 su PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C12 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C15 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C30 PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C1 - C2 ... 1.39 Ang. PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C5 - C6 ... 1.39 Ang. PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C9 - C10 ... 1.39 Ang. PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C13 - C14 ... 1.38 Ang.
1 ALERT level A = In general: serious problem 4 ALERT level B = Potentially serious problem 12 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 12 ALERT type 2 Indicator that the structure model may be wrong or deficient 3 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 1999); cell refinement: SMART; data reduction: SAINT (Bruker, 1999); program(s) used to solve structure: SHELXS97 (Sheldrick, 1997a); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997a); molecular graphics: SHELXTL (Sheldrick, 1997b); software used to prepare material for publication: SHELXTL.

Bis[µ-2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzenethiolato]bis[(η4-3,5- cyclooctadiene)rhodium(I)] top
Crystal data top
[Rh2(C7F7S)2(C8H12)2]F(000) = 1808
Mr = 920.43Dx = 1.994 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
a = 12.5718 (6) ÅCell parameters from 4620 reflections
b = 19.5538 (10) Åθ = 5.3–46.5°
c = 13.3217 (7) ŵ = 1.32 mm1
β = 110.547 (1)°T = 193 K
V = 3066.5 (3) Å3Prism, red
Z = 40.32 × 0.32 × 0.28 mm
Data collection top
Bruker SMART CCD area-detector
diffractometer
4402 independent reflections
Radiation source: fine-focus sealed tube3998 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.018
φ and ω scansθmax = 23.3°, θmin = 1.9°
Absorption correction: empirical (using intensity measurements)
(SADABS; Blessing, 1995)
h = 1113
Tmin = 0.613, Tmax = 0.691k = 1921
13638 measured reflectionsl = 1414
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.022Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.052H-atom parameters constrained
S = 1.04 w = 1/[σ2(Fo2) + (0.0245P)2 + 3.0986P]
where P = (Fo2 + 2Fc2)/3
4402 reflections(Δ/σ)max = 0.001
433 parametersΔρmax = 0.49 e Å3
0 restraintsΔρmin = 0.37 e Å3
Special details top

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.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Rh10.299170 (19)0.063465 (11)0.619365 (18)0.02570 (8)
Rh20.492581 (19)0.155319 (12)0.727738 (19)0.02720 (8)
S10.37572 (6)0.15247 (4)0.54169 (6)0.02695 (17)
S20.32286 (6)0.13912 (4)0.76730 (6)0.02850 (17)
F10.00623 (17)0.41026 (11)0.37866 (19)0.0661 (6)
F20.10615 (18)0.45205 (10)0.52583 (17)0.0588 (6)
F30.14734 (18)0.45926 (10)0.38458 (18)0.0588 (6)
F40.11881 (14)0.16866 (9)0.46015 (14)0.0370 (4)
F50.00023 (14)0.28158 (10)0.41338 (15)0.0442 (5)
F60.33969 (15)0.41114 (8)0.52715 (15)0.0421 (5)
F70.45852 (13)0.29763 (8)0.57411 (14)0.0371 (4)
F80.0877 (2)0.35743 (13)0.7383 (2)0.0826 (8)
F90.0283 (2)0.43276 (12)0.7277 (2)0.0768 (8)
F100.0777 (2)0.38418 (13)0.58649 (17)0.0738 (7)
F110.06951 (15)0.13386 (9)0.67580 (16)0.0452 (5)
F120.07679 (15)0.23532 (11)0.64595 (16)0.0518 (5)
F130.22897 (16)0.39312 (9)0.75109 (15)0.0467 (5)
F140.37305 (14)0.29210 (9)0.78140 (14)0.0378 (4)
C10.2573 (3)0.00369 (16)0.4766 (3)0.0361 (8)
H1A0.25090.03100.41130.043*
C20.3683 (3)0.01024 (15)0.5413 (3)0.0378 (8)
H2A0.42630.00890.51350.045*
C30.4060 (3)0.07504 (18)0.6064 (3)0.0537 (10)
H3A0.48430.08630.61080.064*
H3B0.35590.11320.56900.064*
C40.4033 (3)0.06880 (18)0.7191 (3)0.0558 (10)
H4A0.38830.11450.74320.067*
H4B0.47910.05390.76780.067*
C50.3156 (3)0.01958 (16)0.7291 (3)0.0421 (8)
H5A0.32760.00510.80430.051*
C60.2029 (3)0.01634 (16)0.6597 (3)0.0400 (8)
H6A0.14910.00070.69430.048*
C70.1498 (3)0.06637 (18)0.5688 (3)0.0512 (9)
H7A0.06920.07350.56050.061*
H7B0.18920.11090.58750.061*
C80.1562 (3)0.04175 (19)0.4627 (3)0.0523 (10)
H8A0.16020.08190.41900.063*
H8B0.08590.01630.42310.063*
C90.5891 (3)0.11520 (19)0.8827 (3)0.0468 (9)
H9A0.54250.09440.92220.056*
C100.5940 (3)0.18646 (19)0.8861 (3)0.0457 (9)
H10A0.54980.20780.92730.055*
C110.6929 (3)0.2285 (2)0.8838 (4)0.0673 (12)
H11A0.67310.27740.88540.081*
H11B0.75820.21900.95010.081*
C120.7294 (3)0.2176 (3)0.7919 (4)0.0761 (14)
H12A0.79950.18960.81580.091*
H12B0.74880.26250.76860.091*
C130.6438 (3)0.18309 (18)0.6972 (3)0.0430 (8)
H13A0.62930.20730.62750.052*
C140.6295 (3)0.11306 (18)0.6878 (3)0.0462 (9)
H14A0.60580.09650.61210.055*
C150.6912 (4)0.0605 (2)0.7677 (5)0.0835 (15)
H15A0.77190.06060.77360.100*
H15B0.65940.01500.74060.100*
C160.6857 (3)0.0703 (2)0.8769 (4)0.0709 (14)
H16A0.75840.09050.92360.085*
H16B0.67880.02480.90660.085*
C170.2939 (2)0.22784 (14)0.5190 (2)0.0239 (6)
C180.1760 (2)0.22820 (15)0.4769 (2)0.0269 (7)
C190.1132 (2)0.28763 (15)0.4516 (2)0.0284 (7)
C200.1652 (2)0.35138 (15)0.4654 (2)0.0286 (7)
C210.2835 (2)0.35146 (14)0.5091 (2)0.0286 (7)
C220.3446 (2)0.29238 (15)0.5337 (2)0.0263 (7)
C230.1021 (3)0.41792 (17)0.4378 (3)0.0398 (8)
C240.2273 (2)0.20863 (15)0.7311 (2)0.0257 (6)
C250.1108 (3)0.19783 (16)0.6954 (2)0.0316 (7)
C260.0346 (3)0.25040 (17)0.6804 (2)0.0355 (7)
C270.0700 (3)0.31784 (17)0.7009 (2)0.0346 (7)
C280.1858 (3)0.32930 (15)0.7332 (2)0.0330 (7)
C290.2616 (2)0.27650 (15)0.7485 (2)0.0286 (7)
C300.0169 (3)0.3733 (2)0.6880 (3)0.0477 (9)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Rh10.02879 (14)0.02009 (13)0.03024 (14)0.00077 (9)0.01289 (10)0.00001 (10)
Rh20.02216 (13)0.02637 (14)0.03125 (14)0.00361 (9)0.00709 (10)0.00095 (10)
S10.0290 (4)0.0239 (4)0.0299 (4)0.0024 (3)0.0129 (3)0.0009 (3)
S20.0306 (4)0.0273 (4)0.0291 (4)0.0036 (3)0.0125 (3)0.0003 (3)
F10.0404 (13)0.0497 (13)0.0861 (17)0.0135 (10)0.0053 (11)0.0060 (12)
F20.0737 (15)0.0462 (12)0.0602 (14)0.0208 (11)0.0282 (11)0.0048 (10)
F30.0670 (14)0.0439 (12)0.0726 (14)0.0200 (10)0.0336 (12)0.0266 (11)
F40.0312 (9)0.0308 (10)0.0448 (10)0.0084 (8)0.0079 (8)0.0001 (8)
F50.0219 (9)0.0492 (12)0.0542 (12)0.0037 (8)0.0042 (8)0.0040 (9)
F60.0429 (11)0.0229 (10)0.0552 (12)0.0046 (8)0.0107 (9)0.0017 (8)
F70.0228 (9)0.0318 (10)0.0518 (11)0.0029 (7)0.0068 (8)0.0009 (8)
F80.0809 (18)0.0835 (18)0.109 (2)0.0406 (14)0.0649 (16)0.0178 (15)
F90.0695 (16)0.0514 (15)0.0916 (18)0.0285 (12)0.0060 (13)0.0173 (13)
F100.0714 (16)0.0832 (17)0.0491 (14)0.0423 (13)0.0011 (11)0.0076 (12)
F110.0334 (10)0.0376 (11)0.0630 (13)0.0058 (8)0.0151 (9)0.0009 (9)
F120.0273 (10)0.0645 (14)0.0615 (13)0.0060 (9)0.0131 (9)0.0026 (10)
F130.0567 (12)0.0277 (10)0.0504 (12)0.0038 (9)0.0121 (10)0.0051 (9)
F140.0307 (10)0.0334 (10)0.0453 (11)0.0034 (8)0.0084 (8)0.0064 (8)
C10.051 (2)0.0279 (17)0.0344 (18)0.0061 (15)0.0206 (16)0.0059 (14)
C20.046 (2)0.0255 (17)0.052 (2)0.0038 (14)0.0300 (17)0.0033 (15)
C30.058 (2)0.034 (2)0.072 (3)0.0114 (17)0.027 (2)0.0000 (18)
C40.068 (3)0.0295 (19)0.062 (2)0.0120 (18)0.013 (2)0.0121 (17)
C50.066 (2)0.0251 (17)0.0384 (19)0.0039 (16)0.0215 (18)0.0072 (15)
C60.051 (2)0.0317 (18)0.048 (2)0.0067 (15)0.0301 (18)0.0028 (15)
C70.054 (2)0.039 (2)0.066 (3)0.0150 (17)0.028 (2)0.0063 (18)
C80.054 (2)0.044 (2)0.054 (2)0.0179 (18)0.0139 (19)0.0133 (18)
C90.038 (2)0.055 (2)0.0346 (19)0.0015 (17)0.0031 (15)0.0148 (17)
C100.041 (2)0.052 (2)0.0341 (19)0.0085 (17)0.0000 (15)0.0087 (16)
C110.066 (3)0.043 (2)0.073 (3)0.014 (2)0.000 (2)0.013 (2)
C120.040 (2)0.085 (3)0.100 (4)0.022 (2)0.021 (2)0.021 (3)
C130.0245 (17)0.047 (2)0.059 (2)0.0020 (15)0.0167 (16)0.0057 (18)
C140.0302 (19)0.049 (2)0.063 (2)0.0115 (16)0.0208 (17)0.0021 (18)
C150.067 (3)0.068 (3)0.124 (5)0.035 (2)0.044 (3)0.026 (3)
C160.062 (3)0.040 (2)0.075 (3)0.016 (2)0.021 (2)0.006 (2)
C170.0258 (16)0.0264 (16)0.0196 (14)0.0026 (12)0.0081 (12)0.0009 (12)
C180.0305 (17)0.0272 (16)0.0225 (15)0.0053 (13)0.0089 (13)0.0000 (12)
C190.0228 (16)0.0367 (18)0.0234 (15)0.0012 (13)0.0053 (12)0.0016 (13)
C200.0320 (17)0.0298 (17)0.0227 (15)0.0068 (13)0.0078 (13)0.0029 (13)
C210.0339 (18)0.0228 (16)0.0290 (16)0.0038 (13)0.0109 (13)0.0029 (13)
C220.0224 (16)0.0311 (17)0.0247 (15)0.0011 (13)0.0073 (12)0.0004 (13)
C230.038 (2)0.039 (2)0.0404 (19)0.0088 (15)0.0114 (16)0.0019 (16)
C240.0268 (16)0.0303 (17)0.0211 (14)0.0047 (13)0.0098 (12)0.0011 (12)
C250.0338 (18)0.0337 (18)0.0294 (16)0.0011 (14)0.0138 (14)0.0001 (14)
C260.0271 (17)0.049 (2)0.0317 (17)0.0056 (15)0.0118 (14)0.0023 (15)
C270.0383 (19)0.039 (2)0.0262 (16)0.0129 (15)0.0112 (14)0.0024 (14)
C280.047 (2)0.0266 (17)0.0246 (16)0.0034 (15)0.0117 (14)0.0019 (13)
C290.0298 (17)0.0347 (18)0.0211 (15)0.0005 (14)0.0086 (13)0.0015 (13)
C300.047 (2)0.054 (2)0.039 (2)0.0199 (18)0.0108 (18)0.0038 (18)
Geometric parameters (Å, º) top
Rh1—C22.132 (3)C6—C71.517 (5)
Rh1—C12.135 (3)C6—H6A1.0000
Rh1—C52.146 (3)C7—C81.523 (5)
Rh1—C62.155 (3)C7—H7A0.9900
Rh1—S12.3927 (8)C7—H7B0.9900
Rh1—S22.3977 (8)C8—H8A0.9900
Rh1—Rh22.9595 (3)C8—H8B0.9900
Rh2—C102.135 (3)C9—C101.395 (5)
Rh2—C142.138 (3)C9—C161.523 (5)
Rh2—C92.143 (3)C9—H9A1.0000
Rh2—C132.149 (3)C10—C111.499 (5)
Rh2—S22.3917 (8)C10—H10A1.0000
Rh2—S12.3976 (8)C11—C121.466 (6)
S1—C171.762 (3)C11—H11A0.9900
S2—C241.765 (3)C11—H11B0.9900
F1—C231.321 (4)C12—C131.501 (5)
F2—C231.334 (4)C12—H12A0.9900
F3—C231.328 (4)C12—H12B0.9900
F4—C181.345 (3)C13—C141.381 (5)
F5—C191.341 (3)C13—H13A1.0000
F6—C211.342 (3)C14—C151.486 (6)
F7—C221.345 (3)C14—H14A1.0000
F8—C301.324 (4)C15—C161.493 (6)
F9—C301.321 (4)C15—H15A0.9900
F10—C301.317 (4)C15—H15B0.9900
F11—C251.344 (3)C16—H16A0.9900
F12—C261.344 (3)C16—H16B0.9900
F13—C281.348 (3)C17—C181.388 (4)
F14—C291.348 (3)C17—C221.396 (4)
C1—C21.386 (4)C18—C191.378 (4)
C1—C81.507 (4)C19—C201.389 (4)
C1—H1A1.0000C20—C211.394 (4)
C2—C31.514 (5)C20—C231.501 (4)
C2—H2A1.0000C21—C221.362 (4)
C3—C41.519 (5)C24—C251.388 (4)
C3—H3A0.9900C24—C291.390 (4)
C3—H3B0.9900C25—C261.371 (4)
C4—C51.504 (5)C26—C271.388 (5)
C4—H4A0.9900C27—C281.384 (4)
C4—H4B0.9900C27—C301.506 (4)
C5—C61.396 (5)C28—C291.371 (4)
C5—H5A1.0000
C2—Rh1—C137.90 (12)C10—C9—C16123.4 (3)
C2—Rh1—C582.10 (13)C10—C9—Rh270.65 (18)
C1—Rh1—C597.32 (13)C16—C9—Rh2110.7 (3)
C2—Rh1—C689.58 (13)C10—C9—H9A114.6
C1—Rh1—C680.85 (12)C16—C9—H9A114.6
C5—Rh1—C637.86 (12)Rh2—C9—H9A114.6
C2—Rh1—S189.21 (9)C9—C10—C11125.1 (3)
C1—Rh1—S191.37 (9)C9—C10—Rh271.30 (19)
C5—Rh1—S1152.61 (10)C11—C10—Rh2110.4 (3)
C6—Rh1—S1168.74 (9)C9—C10—H10A114.0
C2—Rh1—S2149.71 (9)C11—C10—H10A114.0
C1—Rh1—S2172.16 (9)Rh2—C10—H10A114.0
C5—Rh1—S287.26 (9)C12—C11—C10116.2 (3)
C6—Rh1—S299.23 (9)C12—C11—H11A108.2
S1—Rh1—S287.36 (3)C10—C11—H11A108.2
C2—Rh1—Rh2104.04 (9)C12—C11—H11B108.2
C1—Rh1—Rh2132.11 (9)C10—C11—H11B108.2
C5—Rh1—Rh2105.11 (9)H11A—C11—H11B107.4
C6—Rh1—Rh2139.02 (9)C11—C12—C13115.2 (3)
S1—Rh1—Rh251.919 (19)C11—C12—H12A108.5
S2—Rh1—Rh251.745 (19)C13—C12—H12A108.5
C10—Rh2—C1495.84 (14)C11—C12—H12B108.5
C10—Rh2—C938.06 (13)C13—C12—H12B108.5
C14—Rh2—C982.24 (14)H12A—C12—H12B107.5
C10—Rh2—C1381.58 (14)C14—C13—C12123.6 (4)
C14—Rh2—C1337.58 (13)C14—C13—Rh270.80 (19)
C9—Rh2—C1392.04 (14)C12—C13—Rh2112.0 (3)
C10—Rh2—S295.16 (10)C14—C13—H13A114.2
C14—Rh2—S2149.55 (10)C12—C13—H13A114.2
C9—Rh2—S289.23 (10)Rh2—C13—H13A114.2
C13—Rh2—S2172.83 (10)C13—C14—C15127.0 (4)
C10—Rh2—S1164.74 (10)C13—C14—Rh271.62 (19)
C14—Rh2—S189.35 (10)C15—C14—Rh2110.6 (3)
C9—Rh2—S1157.20 (10)C13—C14—H14A113.2
C13—Rh2—S194.12 (10)C15—C14—H14A113.2
S2—Rh2—S187.38 (3)Rh2—C14—H14A113.2
C10—Rh2—Rh1139.35 (10)C14—C15—C16114.7 (4)
C14—Rh2—Rh1103.86 (10)C14—C15—H15A108.6
C9—Rh2—Rh1109.78 (10)C16—C15—H15A108.6
C13—Rh2—Rh1133.70 (10)C14—C15—H15B108.6
S2—Rh2—Rh151.928 (19)C16—C15—H15B108.6
S1—Rh2—Rh151.771 (18)H15A—C15—H15B107.6
C17—S1—Rh1112.54 (10)C15—C16—C9115.7 (3)
C17—S1—Rh2105.47 (9)C15—C16—H16A108.4
Rh1—S1—Rh276.31 (2)C9—C16—H16A108.4
C24—S2—Rh2114.32 (10)C15—C16—H16B108.4
C24—S2—Rh1111.95 (9)C9—C16—H16B108.4
Rh2—S2—Rh176.33 (2)H16A—C16—H16B107.4
C2—C1—C8125.6 (3)C18—C17—C22115.0 (2)
C2—C1—Rh170.96 (18)C18—C17—S1123.3 (2)
C8—C1—Rh1111.5 (2)C22—C17—S1121.4 (2)
C2—C1—H1A113.7F4—C18—C19117.5 (2)
C8—C1—H1A113.7F4—C18—C17119.7 (3)
Rh1—C1—H1A113.7C19—C18—C17122.8 (3)
C1—C2—C3124.4 (3)F5—C19—C18117.4 (3)
C1—C2—Rh171.14 (17)F5—C19—C20121.2 (3)
C3—C2—Rh1112.7 (2)C18—C19—C20121.4 (3)
C1—C2—H2A113.7C19—C20—C21116.1 (3)
C3—C2—H2A113.7C19—C20—C23124.2 (3)
Rh1—C2—H2A113.7C21—C20—C23119.7 (3)
C2—C3—C4112.8 (3)F6—C21—C22118.5 (3)
C2—C3—H3A109.0F6—C21—C20119.6 (3)
C4—C3—H3A109.0C22—C21—C20121.9 (3)
C2—C3—H3B109.0F7—C22—C21117.6 (2)
C4—C3—H3B109.0F7—C22—C17119.6 (2)
H3A—C3—H3B107.8C21—C22—C17122.8 (3)
C5—C4—C3114.2 (3)F1—C23—F3107.2 (3)
C5—C4—H4A108.7F1—C23—F2107.1 (3)
C3—C4—H4A108.7F3—C23—F2105.9 (3)
C5—C4—H4B108.7F1—C23—C20113.2 (3)
C3—C4—H4B108.7F3—C23—C20111.7 (3)
H4A—C4—H4B107.6F2—C23—C20111.4 (3)
C6—C5—C4125.1 (3)C25—C24—C29115.5 (3)
C6—C5—Rh171.42 (18)C25—C24—S2120.8 (2)
C4—C5—Rh1108.8 (2)C29—C24—S2123.2 (2)
C6—C5—H5A114.4F11—C25—C26117.8 (3)
C4—C5—H5A114.4F11—C25—C24119.8 (3)
Rh1—C5—H5A114.4C26—C25—C24122.4 (3)
C5—C6—C7124.0 (3)F12—C26—C25118.5 (3)
C5—C6—Rh170.72 (18)F12—C26—C27119.9 (3)
C7—C6—Rh1113.4 (2)C25—C26—C27121.6 (3)
C5—C6—H6A113.8C28—C27—C26116.4 (3)
C7—C6—H6A113.8C28—C27—C30124.1 (3)
Rh1—C6—H6A113.8C26—C27—C30119.5 (3)
C6—C7—C8112.7 (3)F13—C28—C29117.1 (3)
C6—C7—H7A109.1F13—C28—C27121.3 (3)
C8—C7—H7A109.1C29—C28—C27121.6 (3)
C6—C7—H7B109.1F14—C29—C28117.8 (3)
C8—C7—H7B109.1F14—C29—C24119.8 (3)
H7A—C7—H7B107.8C28—C29—C24122.4 (3)
C1—C8—C7112.9 (3)F10—C30—F9106.3 (3)
C1—C8—H8A109.0F10—C30—F8107.9 (3)
C7—C8—H8A109.0F9—C30—F8106.0 (3)
C1—C8—H8B109.0F10—C30—C27111.7 (3)
C7—C8—H8B109.0F9—C30—C27113.3 (3)
H8A—C8—H8B107.8F8—C30—C27111.3 (3)
Selected angles (°), distances (Å) and sums of angles (mean values) about the S atom in [Rh(µ-SR)(Ln)]2 (L1 = cod, L2 = dippe) complexes top
SR, LnIsomerA1aA2bA3bRh···RhS···S
SC6F5, L1syn–endo311.7118.487.4, 89.52.9543.369c
294.3
SC6HF4, L1syn–endo313.0117.887.6, 89.82.9563.330d
296.0
SC7F7, L1syn–endo294.3117.486.0, 91.42.9603.308e
302.6
SH, L2syn–exo302.5136.036.03.2813.016f
SCH3, L2bent–anti297.6endo124.683.2endo3.2983.299f
327.7exo16.9exo
SC6H11, L2syn–endo306.9126.486.03.2383.299f
S2C3H6, L2syn–endo289.4129.180.63.2433.171f
SC6H5, L2planar–anti301.0180.077.83.6343.231f
Notes: (a) A1 is the sum of X—S—X angles at S; (b) The angles are defined as shown in the scheme; (c) Cruz-Garritz et al., (1984); (d) Cruz-Garritz et al., (1991); (e) This work; (f) Oster & Jones, (2004)
 

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