Acta Cryst. (2009). E65, m793 [ doi:10.1107/S1600536809022405 ]
3P,P',P''}chloridoplatinium(II) hexafluoridophosphateIn the title compound, [PtCl(C34H33P3)]PF6, the PtII cation adopts a distorted square-planar PtClP3 geometry, arising from the P,P',P''-tridentate triphos ligand and a chloride ion. Four of the F atoms of the PF6- anion are disordered over two sets of positions in a 0.614 (17):0.386 (17) ratio.
The synthesis of (I) by a previously reported proceedure (King, et al., 1971). Crystals where grown by slow solvent evaporation of a saturated dichloromethane solution of (I).
Data collection: APEX2 (Bruker, 2008); cell refinement: SAINT (Bruker, 2008); data reduction: SAINT and XPREP (Bruker, 2008); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008b); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008b); molecular graphics: SHELXTL (Sheldrick, 2008b); software used to prepare material for publication: SHELXL97 (Sheldrick, 2008b).
| [PtCl(C34H33P3)]PF6 | F(000) = 1784 |
| Mr = 910.02 | Dx = 1.725 Mg m−3 |
| Monoclinic, P21/c | Mo Kα radiation, λ = 0.71073 Å |
| Hall symbol: -P 2ybc | Cell parameters from 9957 reflections |
| a = 11.3870 (11) Å | θ = 2.5–25.1° |
| b = 19.6221 (18) Å | µ = 4.32 mm−1 |
| c = 16.4439 (16) Å | T = 298 K |
| β = 107.528 (3)° | Plate, colorless |
| V = 3503.6 (6) Å3 | 0.50 × 0.30 × 0.10 mm |
| Z = 4 |
| Bruker SMART X2S diffractometer | 6155 independent reflections |
| Radiation source: microfocus sealed tube, Bruker | 5269 reflections with I > 2σ(I) |
| graphite | Rint = 0.025 |
| Detector resolution: 8.33 pixels mm-1 | θmax = 25.1°, θmin = 2.8° |
| ω scans | h = −13→13 |
| Absorption correction: multi-scan (SADABS; Sheldrick, 2008a) | k = −18→23 |
| Tmin = 0.21, Tmax = 0.65 | l = −19→19 |
| 21968 measured reflections |
| 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)] = 0.020 | Hydrogen site location: inferred from neighbouring sites |
| wR(F2) = 0.049 | H-atom parameters constrained |
| S = 1.03 | w = 1/[σ2(Fo2) + (0.0227P)2 + 1.641P] where P = (Fo2 + 2Fc2)/3 |
| 6155 reflections | (Δ/σ)max = 0.002 |
| 452 parameters | Δρmax = 0.58 e Å−3 |
| 204 restraints | Δρmin = −0.41 e Å−3 |
| [PtCl(C34H33P3)]PF6 | V = 3503.6 (6) Å3 |
| Mr = 910.02 | Z = 4 |
| Monoclinic, P21/c | Mo Kα radiation |
| a = 11.3870 (11) Å | µ = 4.32 mm−1 |
| b = 19.6221 (18) Å | T = 298 K |
| c = 16.4439 (16) Å | 0.50 × 0.30 × 0.10 mm |
| β = 107.528 (3)° |
| Bruker SMART X2S diffractometer | 6155 independent reflections |
| Absorption correction: multi-scan (SADABS; Sheldrick, 2008a) | 5269 reflections with I > 2σ(I) |
| Tmin = 0.21, Tmax = 0.65 | Rint = 0.025 |
| 21968 measured reflections | θmax = 25.1° |
| R[F2 > 2σ(F2)] = 0.020 | H-atom parameters constrained |
| wR(F2) = 0.049 | Δρmax = 0.58 e Å−3 |
| S = 1.03 | Δρmin = −0.41 e Å−3 |
| 6155 reflections | Absolute structure: ? |
| 452 parameters | Flack parameter: ? |
| 204 restraints | Rogers parameter: ? |
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. The PF6 anion is disordered, showing alternate positions of the 4 F atoms F3—F6 when rotated about the axis F1—P4—F2. A second orientation for these equatorial positions was located. Based on the thermal parameters, additional positions are indicated, but were not modeled. To improve the quality of the fit for this anion, distance restraints (SHELX SADI) were added for the P–F bonds, as well as for the F–F interatomic distances. These account for 156 of the 204 restraints applied. The remaining restraints (ISOR) were applied to the anisotropic displacement parameters for the fluorine atoms. 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) | |
| Pt1 | 0.139852 (10) | 0.364806 (6) | 0.374003 (7) | 0.03173 (5) | |
| Cl1 | 0.31867 (8) | 0.35123 (5) | 0.48942 (5) | 0.0498 (2) | |
| P1 | 0.22200 (7) | 0.43573 (4) | 0.29227 (5) | 0.03695 (19) | |
| P2 | −0.03648 (7) | 0.37743 (4) | 0.27189 (5) | 0.03518 (19) | |
| P3 | 0.03774 (7) | 0.28264 (4) | 0.42630 (5) | 0.03706 (19) | |
| C1 | 0.3286 (3) | 0.39017 (18) | 0.2487 (2) | 0.0417 (8) | |
| C2 | 0.3950 (4) | 0.3357 (2) | 0.2925 (3) | 0.0696 (12) | |
| H2 | 0.3851 | 0.3227 | 0.3444 | 0.084* | |
| C3 | 0.4758 (5) | 0.3003 (3) | 0.2602 (4) | 0.0929 (17) | |
| H3 | 0.5209 | 0.2641 | 0.2909 | 0.111* | |
| C4 | 0.4896 (4) | 0.3182 (3) | 0.1838 (3) | 0.0811 (14) | |
| H4 | 0.5422 | 0.2933 | 0.1614 | 0.097* | |
| C5 | 0.4268 (4) | 0.3724 (3) | 0.1397 (3) | 0.0809 (15) | |
| H5 | 0.4382 | 0.3850 | 0.0881 | 0.097* | |
| C6 | 0.3458 (4) | 0.4088 (2) | 0.1716 (2) | 0.0662 (12) | |
| H6 | 0.3030 | 0.4457 | 0.1413 | 0.079* | |
| C7 | 0.2923 (3) | 0.51580 (17) | 0.3367 (2) | 0.0448 (8) | |
| C8 | 0.3091 (4) | 0.5681 (2) | 0.2843 (3) | 0.0690 (12) | |
| H8 | 0.2889 | 0.5616 | 0.2257 | 0.083* | |
| C9 | 0.3563 (5) | 0.6303 (2) | 0.3202 (4) | 0.0815 (15) | |
| H9 | 0.3673 | 0.6653 | 0.2852 | 0.098* | |
| C10 | 0.3863 (4) | 0.6405 (2) | 0.4054 (4) | 0.0774 (15) | |
| H10 | 0.4162 | 0.6827 | 0.4283 | 0.093* | |
| C11 | 0.3726 (4) | 0.5886 (2) | 0.4579 (3) | 0.0774 (14) | |
| H11 | 0.3950 | 0.5954 | 0.5166 | 0.093* | |
| C12 | 0.3255 (3) | 0.5262 (2) | 0.4237 (3) | 0.0587 (10) | |
| H12 | 0.3162 | 0.4913 | 0.4595 | 0.070* | |
| C13 | 0.0924 (3) | 0.46082 (19) | 0.2000 (2) | 0.0480 (9) | |
| H13A | 0.0534 | 0.5012 | 0.2141 | 0.058* | |
| H13B | 0.1226 | 0.4718 | 0.1524 | 0.058* | |
| C14 | −0.0024 (3) | 0.40301 (19) | 0.1745 (2) | 0.0459 (8) | |
| H14A | 0.0311 | 0.3649 | 0.1510 | 0.055* | |
| H14B | −0.0766 | 0.4188 | 0.1320 | 0.055* | |
| C15 | −0.1372 (3) | 0.44123 (17) | 0.2947 (2) | 0.0392 (8) | |
| C16 | −0.2526 (3) | 0.4525 (2) | 0.2376 (2) | 0.0612 (11) | |
| H16 | −0.2769 | 0.4292 | 0.1860 | 0.073* | |
| C17 | −0.3320 (4) | 0.4987 (2) | 0.2575 (3) | 0.0777 (13) | |
| H17 | −0.4097 | 0.5061 | 0.2192 | 0.093* | |
| C18 | −0.2964 (4) | 0.5334 (2) | 0.3334 (3) | 0.0718 (12) | |
| H18 | −0.3501 | 0.5642 | 0.3462 | 0.086* | |
| C19 | −0.1830 (4) | 0.5230 (2) | 0.3901 (3) | 0.0655 (11) | |
| H19 | −0.1593 | 0.5468 | 0.4413 | 0.079* | |
| C20 | −0.1031 (3) | 0.47681 (18) | 0.3711 (2) | 0.0512 (9) | |
| H20 | −0.0258 | 0.4696 | 0.4100 | 0.061* | |
| C21 | −0.1212 (3) | 0.29792 (17) | 0.2618 (2) | 0.0446 (8) | |
| H21A | −0.2052 | 0.3041 | 0.2255 | 0.054* | |
| H21B | −0.0824 | 0.2631 | 0.2368 | 0.054* | |
| C22 | −0.1201 (3) | 0.27699 (19) | 0.3519 (2) | 0.0500 (9) | |
| H22A | −0.1502 | 0.2307 | 0.3510 | 0.060* | |
| H22B | −0.1743 | 0.3067 | 0.3713 | 0.060* | |
| C23 | 0.0305 (3) | 0.29942 (17) | 0.5330 (2) | 0.0413 (8) | |
| C24 | −0.0603 (3) | 0.3399 (2) | 0.5480 (2) | 0.0529 (9) | |
| H24 | −0.1274 | 0.3533 | 0.5027 | 0.063* | |
| C25 | −0.0518 (4) | 0.3605 (2) | 0.6305 (3) | 0.0605 (11) | |
| H25 | −0.1135 | 0.3874 | 0.6402 | 0.073* | |
| C26 | 0.0467 (4) | 0.3415 (2) | 0.6974 (2) | 0.0590 (10) | |
| H26 | 0.0533 | 0.3564 | 0.7523 | 0.071* | |
| C27 | 0.1362 (4) | 0.3003 (2) | 0.6833 (2) | 0.0614 (11) | |
| H27 | 0.2024 | 0.2865 | 0.7290 | 0.074* | |
| C28 | 0.1287 (3) | 0.2791 (2) | 0.6017 (2) | 0.0538 (9) | |
| H28 | 0.1896 | 0.2512 | 0.5929 | 0.065* | |
| C29 | 0.1039 (3) | 0.19806 (16) | 0.42953 (19) | 0.0387 (8) | |
| C30 | 0.0425 (4) | 0.14216 (19) | 0.4497 (2) | 0.0539 (10) | |
| H30 | −0.0322 | 0.1483 | 0.4609 | 0.065* | |
| C31 | 0.0923 (5) | 0.0778 (2) | 0.4532 (3) | 0.0677 (12) | |
| H31 | 0.0515 | 0.0407 | 0.4673 | 0.081* | |
| C32 | 0.2015 (4) | 0.0680 (2) | 0.4359 (3) | 0.0675 (12) | |
| H32 | 0.2343 | 0.0244 | 0.4381 | 0.081* | |
| C33 | 0.2626 (4) | 0.1225 (2) | 0.4153 (3) | 0.0610 (11) | |
| H33 | 0.3362 | 0.1157 | 0.4029 | 0.073* | |
| C34 | 0.2149 (3) | 0.18766 (18) | 0.4131 (2) | 0.0456 (8) | |
| H34 | 0.2575 | 0.2246 | 0.4005 | 0.055* | |
| P4 | 0.33951 (10) | 0.86107 (6) | 0.53542 (7) | 0.0655 (3) | |
| F1 | 0.2344 (3) | 0.91309 (17) | 0.5407 (2) | 0.1331 (13) | |
| F2 | 0.4424 (3) | 0.81198 (16) | 0.5283 (2) | 0.1263 (12) | |
| F3 | 0.4311 (7) | 0.8949 (6) | 0.6137 (6) | 0.170 (6) | 0.614 (17) |
| F4 | 0.2458 (8) | 0.8302 (5) | 0.4551 (7) | 0.181 (7) | 0.614 (17) |
| F5 | 0.3788 (11) | 0.9131 (4) | 0.4771 (7) | 0.143 (6) | 0.614 (17) |
| F6 | 0.2992 (7) | 0.8122 (5) | 0.5916 (7) | 0.196 (7) | 0.614 (17) |
| F3' | 0.3623 (16) | 0.8459 (7) | 0.6302 (5) | 0.170 (11) | 0.386 (17) |
| F4' | 0.3028 (14) | 0.8713 (10) | 0.4399 (5) | 0.184 (10) | 0.386 (17) |
| F5' | 0.4294 (9) | 0.9199 (4) | 0.5545 (15) | 0.153 (11) | 0.386 (17) |
| F6' | 0.2434 (11) | 0.8018 (5) | 0.5150 (11) | 0.141 (9) | 0.386 (17) |
| U11 | U22 | U33 | U12 | U13 | U23 | |
| Pt1 | 0.02685 (7) | 0.03558 (8) | 0.03213 (7) | −0.00116 (5) | 0.00792 (5) | 0.00172 (5) |
| Cl1 | 0.0352 (4) | 0.0585 (6) | 0.0467 (5) | −0.0016 (4) | −0.0013 (4) | 0.0038 (4) |
| P1 | 0.0324 (4) | 0.0385 (5) | 0.0422 (5) | 0.0009 (4) | 0.0147 (4) | 0.0056 (4) |
| P2 | 0.0290 (4) | 0.0438 (5) | 0.0311 (4) | 0.0000 (4) | 0.0066 (3) | −0.0002 (3) |
| P3 | 0.0322 (4) | 0.0416 (5) | 0.0385 (4) | −0.0023 (4) | 0.0124 (4) | 0.0045 (4) |
| C1 | 0.0343 (17) | 0.046 (2) | 0.0465 (19) | −0.0013 (15) | 0.0144 (15) | −0.0008 (16) |
| C2 | 0.069 (3) | 0.069 (3) | 0.086 (3) | 0.022 (2) | 0.047 (3) | 0.023 (2) |
| C3 | 0.095 (4) | 0.080 (4) | 0.126 (4) | 0.042 (3) | 0.067 (4) | 0.029 (3) |
| C4 | 0.069 (3) | 0.085 (4) | 0.103 (4) | 0.011 (3) | 0.046 (3) | −0.021 (3) |
| C5 | 0.061 (3) | 0.134 (5) | 0.056 (3) | 0.015 (3) | 0.029 (2) | −0.004 (3) |
| C6 | 0.057 (2) | 0.095 (3) | 0.051 (2) | 0.021 (2) | 0.023 (2) | 0.009 (2) |
| C7 | 0.0338 (18) | 0.039 (2) | 0.064 (2) | −0.0003 (15) | 0.0188 (17) | 0.0049 (17) |
| C8 | 0.081 (3) | 0.051 (3) | 0.087 (3) | −0.012 (2) | 0.043 (3) | 0.004 (2) |
| C9 | 0.083 (3) | 0.046 (3) | 0.122 (5) | −0.012 (2) | 0.041 (3) | 0.014 (3) |
| C10 | 0.047 (2) | 0.049 (3) | 0.122 (4) | −0.014 (2) | 0.003 (3) | −0.006 (3) |
| C11 | 0.063 (3) | 0.063 (3) | 0.084 (3) | −0.006 (2) | −0.014 (2) | −0.005 (3) |
| C12 | 0.049 (2) | 0.048 (2) | 0.068 (3) | −0.0065 (18) | 0.0007 (19) | 0.0046 (19) |
| C13 | 0.0418 (19) | 0.057 (2) | 0.048 (2) | 0.0080 (17) | 0.0177 (16) | 0.0167 (17) |
| C14 | 0.0408 (18) | 0.063 (2) | 0.0335 (17) | 0.0071 (18) | 0.0111 (14) | 0.0050 (16) |
| C15 | 0.0340 (17) | 0.042 (2) | 0.0423 (18) | 0.0025 (15) | 0.0124 (15) | 0.0026 (15) |
| C16 | 0.044 (2) | 0.074 (3) | 0.058 (2) | 0.008 (2) | 0.0042 (18) | −0.010 (2) |
| C17 | 0.045 (2) | 0.084 (3) | 0.094 (3) | 0.020 (2) | 0.006 (2) | −0.006 (3) |
| C18 | 0.057 (3) | 0.064 (3) | 0.098 (3) | 0.015 (2) | 0.028 (3) | −0.015 (3) |
| C19 | 0.066 (3) | 0.063 (3) | 0.067 (3) | 0.008 (2) | 0.019 (2) | −0.017 (2) |
| C20 | 0.045 (2) | 0.052 (2) | 0.053 (2) | 0.0059 (17) | 0.0090 (17) | −0.0046 (18) |
| C21 | 0.0377 (18) | 0.044 (2) | 0.0468 (19) | −0.0053 (15) | 0.0043 (15) | −0.0068 (16) |
| C22 | 0.0346 (18) | 0.055 (2) | 0.058 (2) | −0.0089 (16) | 0.0104 (16) | 0.0066 (18) |
| C23 | 0.0398 (18) | 0.045 (2) | 0.0432 (18) | −0.0014 (15) | 0.0189 (15) | 0.0061 (15) |
| C24 | 0.047 (2) | 0.063 (2) | 0.051 (2) | 0.0083 (19) | 0.0199 (18) | 0.0037 (19) |
| C25 | 0.060 (3) | 0.069 (3) | 0.062 (3) | 0.009 (2) | 0.032 (2) | 0.000 (2) |
| C26 | 0.076 (3) | 0.062 (3) | 0.046 (2) | 0.002 (2) | 0.027 (2) | 0.0018 (19) |
| C27 | 0.067 (3) | 0.073 (3) | 0.042 (2) | 0.012 (2) | 0.0129 (19) | 0.0082 (19) |
| C28 | 0.055 (2) | 0.062 (3) | 0.046 (2) | 0.0145 (19) | 0.0190 (18) | 0.0076 (18) |
| C29 | 0.0413 (18) | 0.040 (2) | 0.0339 (16) | −0.0049 (15) | 0.0096 (14) | 0.0008 (14) |
| C30 | 0.060 (2) | 0.053 (3) | 0.051 (2) | −0.0172 (19) | 0.0205 (19) | −0.0012 (18) |
| C31 | 0.096 (4) | 0.043 (3) | 0.061 (3) | −0.020 (2) | 0.020 (2) | 0.0018 (19) |
| C32 | 0.086 (3) | 0.042 (2) | 0.063 (3) | 0.008 (2) | 0.005 (2) | −0.007 (2) |
| C33 | 0.057 (2) | 0.053 (3) | 0.069 (3) | 0.007 (2) | 0.012 (2) | −0.007 (2) |
| C34 | 0.045 (2) | 0.043 (2) | 0.049 (2) | −0.0006 (16) | 0.0130 (16) | 0.0008 (16) |
| P4 | 0.0518 (6) | 0.0859 (9) | 0.0608 (7) | 0.0022 (6) | 0.0199 (5) | 0.0198 (6) |
| F1 | 0.085 (2) | 0.135 (3) | 0.193 (4) | 0.031 (2) | 0.062 (2) | 0.027 (3) |
| F2 | 0.100 (2) | 0.108 (3) | 0.178 (3) | 0.0275 (19) | 0.052 (2) | −0.005 (2) |
| F3 | 0.082 (5) | 0.309 (16) | 0.115 (7) | −0.058 (7) | 0.025 (4) | −0.069 (8) |
| F4 | 0.133 (9) | 0.174 (11) | 0.166 (11) | 0.000 (7) | −0.061 (7) | −0.044 (8) |
| F5 | 0.200 (12) | 0.121 (8) | 0.155 (10) | 0.039 (7) | 0.122 (9) | 0.062 (7) |
| F6 | 0.121 (6) | 0.265 (13) | 0.210 (13) | −0.036 (7) | 0.061 (8) | 0.170 (11) |
| F3' | 0.27 (3) | 0.174 (15) | 0.051 (5) | 0.124 (16) | 0.023 (9) | 0.000 (7) |
| F4' | 0.183 (16) | 0.31 (3) | 0.047 (6) | −0.042 (14) | 0.010 (8) | 0.053 (10) |
| F5' | 0.083 (8) | 0.077 (7) | 0.31 (3) | −0.036 (5) | 0.079 (15) | −0.040 (13) |
| F6' | 0.163 (15) | 0.110 (10) | 0.198 (19) | −0.074 (10) | 0.130 (15) | −0.031 (10) |
| Pt1—P2 | 2.2095 (8) | C17—C18 | 1.371 (6) |
| Pt1—P3 | 2.3007 (8) | C17—H17 | 0.9300 |
| Pt1—P1 | 2.3185 (8) | C18—C19 | 1.361 (6) |
| Pt1—Cl1 | 2.3434 (8) | C18—H18 | 0.9300 |
| P1—C7 | 1.814 (4) | C19—C20 | 1.384 (5) |
| P1—C1 | 1.819 (3) | C19—H19 | 0.9300 |
| P1—C13 | 1.836 (3) | C20—H20 | 0.9300 |
| P2—C15 | 1.812 (3) | C21—C22 | 1.535 (5) |
| P2—C21 | 1.815 (3) | C21—H21A | 0.9700 |
| P2—C14 | 1.828 (3) | C21—H21B | 0.9700 |
| P3—C23 | 1.812 (3) | C22—H22A | 0.9700 |
| P3—C29 | 1.817 (3) | C22—H22B | 0.9700 |
| P3—C22 | 1.848 (3) | C23—C24 | 1.383 (5) |
| C1—C2 | 1.380 (5) | C23—C28 | 1.387 (5) |
| C1—C6 | 1.389 (5) | C24—C25 | 1.392 (5) |
| C2—C3 | 1.381 (6) | C24—H24 | 0.9300 |
| C2—H2 | 0.9300 | C25—C26 | 1.365 (6) |
| C3—C4 | 1.359 (6) | C25—H25 | 0.9300 |
| C3—H3 | 0.9300 | C26—C27 | 1.375 (5) |
| C4—C5 | 1.362 (6) | C26—H26 | 0.9300 |
| C4—H4 | 0.9300 | C27—C28 | 1.382 (5) |
| C5—C6 | 1.388 (6) | C27—H27 | 0.9300 |
| C5—H5 | 0.9300 | C28—H28 | 0.9300 |
| C6—H6 | 0.9300 | C29—C34 | 1.385 (4) |
| C7—C12 | 1.381 (5) | C29—C30 | 1.393 (5) |
| C7—C8 | 1.390 (5) | C30—C31 | 1.379 (5) |
| C8—C9 | 1.390 (6) | C30—H30 | 0.9300 |
| C8—H8 | 0.9300 | C31—C32 | 1.370 (6) |
| C9—C10 | 1.352 (7) | C31—H31 | 0.9300 |
| C9—H9 | 0.9300 | C32—C33 | 1.372 (6) |
| C10—C11 | 1.375 (6) | C32—H32 | 0.9300 |
| C10—H10 | 0.9300 | C33—C34 | 1.385 (5) |
| C11—C12 | 1.386 (5) | C33—H33 | 0.9300 |
| C11—H11 | 0.9300 | C34—H34 | 0.9300 |
| C12—H12 | 0.9300 | P4—F6 | 1.496 (5) |
| C13—C14 | 1.535 (5) | P4—F5' | 1.512 (8) |
| C13—H13A | 0.9700 | P4—F4' | 1.512 (8) |
| C13—H13B | 0.9700 | P4—F3' | 1.530 (8) |
| C14—H14A | 0.9700 | P4—F3 | 1.542 (7) |
| C14—H14B | 0.9700 | P4—F2 | 1.548 (3) |
| C15—C16 | 1.383 (5) | P4—F4 | 1.549 (6) |
| C15—C20 | 1.387 (5) | P4—F5 | 1.556 (6) |
| C16—C17 | 1.387 (5) | P4—F6' | 1.563 (8) |
| C16—H16 | 0.9300 | P4—F1 | 1.595 (3) |
| P2—Pt1—P3 | 85.22 (3) | C18—C19—C20 | 119.7 (4) |
| P2—Pt1—P1 | 85.71 (3) | C18—C19—H19 | 120.1 |
| P3—Pt1—P1 | 167.13 (3) | C20—C19—H19 | 120.1 |
| P2—Pt1—Cl1 | 175.83 (3) | C19—C20—C15 | 120.7 (3) |
| P3—Pt1—Cl1 | 91.79 (3) | C19—C20—H20 | 119.7 |
| P1—Pt1—Cl1 | 97.69 (3) | C15—C20—H20 | 119.7 |
| C7—P1—C1 | 108.56 (15) | C22—C21—P2 | 107.0 (2) |
| C7—P1—C13 | 104.36 (16) | C22—C21—H21A | 110.3 |
| C1—P1—C13 | 105.78 (16) | P2—C21—H21A | 110.3 |
| C7—P1—Pt1 | 119.51 (12) | C22—C21—H21B | 110.3 |
| C1—P1—Pt1 | 111.53 (12) | P2—C21—H21B | 110.3 |
| C13—P1—Pt1 | 105.99 (11) | H21A—C21—H21B | 108.6 |
| C15—P2—C21 | 105.12 (16) | C21—C22—P3 | 110.3 (2) |
| C15—P2—C14 | 107.82 (16) | C21—C22—H22A | 109.6 |
| C21—P2—C14 | 113.75 (16) | P3—C22—H22A | 109.6 |
| C15—P2—Pt1 | 114.03 (11) | C21—C22—H22B | 109.6 |
| C21—P2—Pt1 | 108.04 (11) | P3—C22—H22B | 109.6 |
| C14—P2—Pt1 | 108.22 (11) | H22A—C22—H22B | 108.1 |
| C23—P3—C29 | 106.08 (15) | C24—C23—C28 | 118.9 (3) |
| C23—P3—C22 | 109.46 (16) | C24—C23—P3 | 122.1 (3) |
| C29—P3—C22 | 106.05 (16) | C28—C23—P3 | 118.4 (3) |
| C23—P3—Pt1 | 114.22 (11) | C23—C24—C25 | 120.3 (4) |
| C29—P3—Pt1 | 113.54 (11) | C23—C24—H24 | 119.9 |
| C22—P3—Pt1 | 107.16 (11) | C25—C24—H24 | 119.9 |
| C2—C1—C6 | 118.3 (3) | C26—C25—C24 | 120.4 (4) |
| C2—C1—P1 | 120.0 (3) | C26—C25—H25 | 119.8 |
| C6—C1—P1 | 121.6 (3) | C24—C25—H25 | 119.8 |
| C1—C2—C3 | 120.9 (4) | C25—C26—C27 | 119.7 (4) |
| C1—C2—H2 | 119.6 | C25—C26—H26 | 120.1 |
| C3—C2—H2 | 119.6 | C27—C26—H26 | 120.1 |
| C4—C3—C2 | 120.1 (4) | C26—C27—C28 | 120.6 (4) |
| C4—C3—H3 | 120.0 | C26—C27—H27 | 119.7 |
| C2—C3—H3 | 120.0 | C28—C27—H27 | 119.7 |
| C3—C4—C5 | 120.4 (4) | C27—C28—C23 | 120.2 (3) |
| C3—C4—H4 | 119.8 | C27—C28—H28 | 119.9 |
| C5—C4—H4 | 119.8 | C23—C28—H28 | 119.9 |
| C4—C5—C6 | 120.2 (4) | C34—C29—C30 | 118.9 (3) |
| C4—C5—H5 | 119.9 | C34—C29—P3 | 121.6 (3) |
| C6—C5—H5 | 119.9 | C30—C29—P3 | 119.5 (3) |
| C5—C6—C1 | 120.1 (4) | C31—C30—C29 | 120.1 (4) |
| C5—C6—H6 | 119.9 | C31—C30—H30 | 120.0 |
| C1—C6—H6 | 119.9 | C29—C30—H30 | 120.0 |
| C12—C7—C8 | 119.1 (4) | C32—C31—C30 | 120.5 (4) |
| C12—C7—P1 | 119.7 (3) | C32—C31—H31 | 119.8 |
| C8—C7—P1 | 121.1 (3) | C30—C31—H31 | 119.8 |
| C7—C8—C9 | 119.5 (4) | C31—C32—C33 | 120.1 (4) |
| C7—C8—H8 | 120.3 | C31—C32—H32 | 119.9 |
| C9—C8—H8 | 120.3 | C33—C32—H32 | 119.9 |
| C10—C9—C8 | 121.0 (4) | C32—C33—C34 | 120.1 (4) |
| C10—C9—H9 | 119.5 | C32—C33—H33 | 119.9 |
| C8—C9—H9 | 119.5 | C34—C33—H33 | 119.9 |
| C9—C10—C11 | 119.9 (4) | C29—C34—C33 | 120.3 (3) |
| C9—C10—H10 | 120.0 | C29—C34—H34 | 119.9 |
| C11—C10—H10 | 120.0 | C33—C34—H34 | 119.9 |
| C10—C11—C12 | 120.2 (5) | F5'—P4—F4' | 94.2 (8) |
| C10—C11—H11 | 119.9 | F5'—P4—F3' | 92.3 (7) |
| C12—C11—H11 | 119.9 | F4'—P4—F3' | 173.1 (8) |
| C7—C12—C11 | 120.2 (4) | F6—P4—F3 | 90.9 (5) |
| C7—C12—H12 | 119.9 | F6—P4—F2 | 91.6 (4) |
| C11—C12—H12 | 119.9 | F5'—P4—F2 | 90.6 (4) |
| C14—C13—P1 | 110.6 (2) | F4'—P4—F2 | 89.0 (5) |
| C14—C13—H13A | 109.5 | F3'—P4—F2 | 93.2 (4) |
| P1—C13—H13A | 109.5 | F3—P4—F2 | 89.6 (4) |
| C14—C13—H13B | 109.5 | F6—P4—F4 | 90.9 (5) |
| P1—C13—H13B | 109.5 | F3—P4—F4 | 177.5 (5) |
| H13A—C13—H13B | 108.1 | F2—P4—F4 | 92.0 (3) |
| C13—C14—P2 | 106.3 (2) | F6—P4—F5 | 178.6 (5) |
| C13—C14—H14A | 110.5 | F3—P4—F5 | 89.1 (4) |
| P2—C14—H14A | 110.5 | F2—P4—F5 | 89.8 (3) |
| C13—C14—H14B | 110.5 | F4—P4—F5 | 89.0 (5) |
| P2—C14—H14B | 110.5 | F5'—P4—F6' | 178.3 (6) |
| H14A—C14—H14B | 108.7 | F4'—P4—F6' | 85.3 (8) |
| C16—C15—C20 | 118.9 (3) | F3'—P4—F6' | 88.1 (6) |
| C16—C15—P2 | 120.1 (3) | F2—P4—F6' | 91.0 (4) |
| C20—C15—P2 | 120.9 (3) | F6—P4—F1 | 90.1 (4) |
| C15—C16—C17 | 119.9 (4) | F5'—P4—F1 | 88.4 (4) |
| C15—C16—H16 | 120.1 | F4'—P4—F1 | 89.7 (5) |
| C17—C16—H16 | 120.1 | F3'—P4—F1 | 88.2 (4) |
| C18—C17—C16 | 120.2 (4) | F3—P4—F1 | 90.5 (4) |
| C18—C17—H17 | 119.9 | F2—P4—F1 | 178.3 (2) |
| C16—C17—H17 | 119.9 | F4—P4—F1 | 87.8 (3) |
| C19—C18—C17 | 120.6 (4) | F5—P4—F1 | 88.5 (3) |
| C19—C18—H18 | 119.7 | F6'—P4—F1 | 90.0 (4) |
| C17—C18—H18 | 119.7 |
| Pt1—P2 | 2.2095 (8) | Pt1—P1 | 2.3185 (8) |
| Pt1—P3 | 2.3007 (8) | Pt1—Cl1 | 2.3434 (8) |
We thank Research Corporation Cottrell Science Award (No. 7293) for funding that supported this research.
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The crystal structure of the title compound, (I), consists of a [Pt(triphos)Cl]+ cation and disordered PF6- anion (Fig. 1). The cation shows a distorted square planar geometry (Table 1) around the metal center with a non-coordinating PF6- anion.