μ-Carbonyl-1:2κ²C-carbonyl-1κC-(1η⁵-cyclo­penta­dien­yl)(μ-phenyl­vinyl­idene)­bis­(triphenyl­phosphine-2κP)­rheniumplatinum(Re—Pt) diethyl ether hemisolvate

The title compound, [PtRe(C₅H₅)(C₈H₆)(C₁₈H₁₅P)₂(CO)₂]·0.5C₄H₁₀O, represents the first example of a structurally characterized μ-vinyl­idene Re–Pt complex, and was obtained as a product of the addition of [Pt(PPh₃)]₂ to (η⁵-C₅H₅)(CO)₂Re=C=CHPh. The two metal atoms are bridged by the μ-phenyl­vinyl­idene ligand. The central fragment of the mol­ecule is an almost planar methyl­enedimetallacyclo­propane RePt(μ-C=CHPh) system. The Re atom is bonded to the η⁵-C₅H₅ ring and two CO groups, one of which has a tendency to a weak semi-bridging inter­action with the Pt atom. The distorted square-planar coordination of the Pt atom is formed by the two P atoms of the PPh₃ ligands, and by two C atoms of the C=CHPh ligand and one of the CO ligands. The solvent molecule is disordered equally over two positions.

Key indicators

• Single-crystal X-ray study
• T = 296 K
• Mean [sigma](C-C) = 0.008 Å
• Disorder in solvent or counterion
• R factor = 0.031
• wR factor = 0.073
• Data-to-parameter ratio = 23.0

checkCIF/PLATON results

No syntax errors found



Alert level C
PLAT041_ALERT_1_C Calc. and Rep. SumFormula Strings    Differ ....          ?
PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ ....          ?
PLAT045_ALERT_1_C Calculated and Reported Z Differ by ............       0.50 Ratio
PLAT062_ALERT_4_C Rescale T(min) & T(max) by .....................       0.83
PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density ....       2.10
PLAT180_ALERT_3_C Check Cell Rounding: # of Values Ending with 0 =          3
PLAT220_ALERT_2_C Large Non-Solvent    C     Ueq(max)/Ueq(min) ...       2.93 Ratio
PLAT242_ALERT_2_C Check Low       Ueq as Compared to Neighbors for         Re
PLAT244_ALERT_4_C Low   'Solvent' Ueq as Compared to Neighbors for         O5
PLAT302_ALERT_4_C Anion/Solvent Disorder .........................      50.00 Perc.
PLAT320_ALERT_2_C Check Hybridisation of  C1     in Main Residue .          ?
PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond  C1     -   C2     ...       1.35 Ang.
PLAT764_ALERT_4_C Overcomplete CIF Bond List Detected (Rep/Expd) .       1.18 Ratio

Alert level G
ABSTM02_ALERT_3_G  When printed, the submitted absorption T values will be
            replaced by the scaled T values. Since the ratio of scaled T's
            is identical to the ratio of reported T values, the scaling
            does not imply a change to the absorption corrections used in
            the study.
            Ratio of Tmax expected/reported      0.832
            Tmax scaled      0.348 Tmin scaled      0.231
PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints .......          4

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
  13 ALERT level C = Check and explain
   2 ALERT level G = General alerts; check

   3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   5 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
   4 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

---

S1. Comment

The molecule of the title compound, [η⁵-C₅H₅)(CO)₂RePt (µ-C?CHPh)(PPh₃)₂] Et₂O, is the dinuclear complex containing the Re and Pt atoms bridged by the µ-phenylvinylidene ligand. The phenyl ring and the C?C bond of vinylidene coupled with the Re—Pt-µ-C triangle form an almost planar system. Corresponding geometry was found for the analogous MnPt complex (Vasiliev et al., 2007). The structures of some µ-carbene (Casey et al., 1992; Bergamo et al., 2000) and µ-carbyne (Bergamo et al., 2000) complexes containing the Re—Pt-µ-C triangle system as the central fragment of molecule were reported.

Related literature

The corresponding geometry in the analogous MnPt complex was reported by Vasiliev et al. (2007). For crystal structures of related µ-carbene complexes containing the Re–Pt–µ-C triangle system, see: Casey et al. (1992); Bergamo et al. (2000). For related literature, see: Allen et al. (1987).

S2. Experimental

The title compound was prepared by the interaction between Cp(CO)₂Re?C?CHPh and Pt(PPh₃)₄ in benzene and at 298 K, 3 h. Suitable single crystals were obtained by recrystallization from ether at 298 K.

S3. Refinement

Seven phenyl cycles were idealized and refined as rigid groups with C—C bond lengths of 1.390 Å. All H atoms were positioned geometrically (C—H 0.93 Å) and refined using a riding model with U_iso(H) = 1.2U_eq(C).

There are the difference density maximum of 3.11 e/ų at a distance of 0.87Šfrom Re atom and the minimum of -1.48 e/ų at a distance of 0.68Šfrom the same atom.

The solvate diethyl ether molecule is situated close to the inversion center (the distance from the center to the oxygen atom about 0.5 Å) with the statistical occupancy of 0.5. A l l non-hydrogen atoms of the solvate molecule were refined isotropically and the C—O and C—C distances were restrained by SHELXL DFIX instructions to values of 1.43 and 1.50 Å respectively (Allen et al., 1987).

Computing details

Data collection: SMART (Bruker, 2001); cell refinement: SMART; data reduction: SAINT (Bruker, 2001); program(s) used to solve structure: SHELXTL (Sheldrick, 2004); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL.

Figures

Fig. 1. The molecular structure of title compound, with atom labels and 50% probability displacement ellipsoids for non-H atoms. H atoms, except for H2 atom, omitted for clarity.

µ-Carbonyl-1:2κ²C-carbonyl-1κC-(1η⁵– cyclopentadienyl)(µ- phenylvinylidene)bis(triphenylphosphine-2κP)rheniumplatinum(Re—Pt) diethyl ether hemisolvate

Crystal data

[PtRe(C5H5)(C8H6)(C18H15P)2(CO)2]·0.5C4H10O	F(000) = 2268
Mr = 1166.13	Dx = 1.709 Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybc	Cell parameters from 9791 reflections
a = 22.529 (1) Å	θ = 2.4–27.4°
b = 9.1786 (5) Å	µ = 5.86 mm^−1
c = 21.941 (1) Å	T = 296 K
β = 92.469 (1)°	Block, orange
V = 4532.9 (4) Å^3	0.36 × 0.21 × 0.18 mm
Z = 4

Data collection

Bruker SMART 4K CCD area-detector diffractometer	10402 independent reflections
Radiation source: fine-focus sealed tube	7336 reflections with I > 2σ(I)
Graphite monochromator	Rint = 0.038
φ and ω scans	θmax = 27.5°, θmin = 1.9°
Absorption correction: multi-scan (SADABS; Sheldrick, 2004)	h = −29→29
Tmin = 0.278, Tmax = 0.418	k = −11→11
38759 measured reflections	l = −28→28

Refinement

Refinement on F^2	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F^2 > 2σ(F^2)] = 0.031	Hydrogen site location: constr
wR(F^2) = 0.073	H-atom parameters constrained
S = 1.00	w = 1/[σ^2(Fo^2) + (0.0315P)^2 + 4.6963P] where P = (Fo^2 + 2Fc^2)/3
10402 reflections	(Δ/σ)max = 0.002
453 parameters	Δρmax = 3.11 e Å^−3
4 restraints	Δρmin = −1.48 e Å^−3

Special details

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 > 2σ(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 (Ų)

	x	y	z	Uiso*/Ueq	Occ. (<1)
Pt	0.248866 (8)	0.446207 (18)	0.314347 (8)	0.03293 (5)
Re	0.186644 (9)	0.56086 (2)	0.215806 (8)	0.04006 (6)
C11	0.1165 (3)	0.5152 (8)	0.1403 (3)	0.0688 (17)
H11	0.0868	0.5833	0.1314	0.083*
C12	0.1711 (3)	0.5085 (8)	0.1141 (2)	0.0674 (17)
H12	0.1843	0.5712	0.0843	0.081*
C13	0.2037 (3)	0.3910 (7)	0.1401 (3)	0.0668 (17)
H13	0.2421	0.3633	0.1311	0.080*
C14	0.1675 (3)	0.3247 (7)	0.1818 (3)	0.0712 (18)
H14	0.1777	0.2430	0.2051	0.085*
C15	0.1135 (3)	0.3995 (8)	0.1833 (3)	0.0707 (18)
H15	0.0819	0.3779	0.2077	0.085*
P1	0.34065 (5)	0.38572 (13)	0.35326 (6)	0.0352 (3)
P2	0.18454 (5)	0.31895 (13)	0.37882 (5)	0.0371 (3)
C1	0.2770 (2)	0.5451 (5)	0.2392 (2)	0.0387 (10)
C2	0.3310 (2)	0.5629 (5)	0.2158 (2)	0.0462 (12)
H2	0.3619	0.5207	0.2390	0.055*
C3	0.1518 (2)	0.6161 (6)	0.2899 (2)	0.0512 (13)
O3	0.12681 (18)	0.6630 (5)	0.33088 (18)	0.0728 (12)
C4	0.1973 (3)	0.7638 (7)	0.2106 (2)	0.0580 (15)
O4	0.2019 (3)	0.8908 (5)	0.2078 (2)	0.0956 (17)
C5	0.35039 (15)	0.6378 (4)	0.15943 (13)	0.0445 (12)
C6	0.41017 (14)	0.6250 (4)	0.14714 (16)	0.0579 (15)
H6	0.4351	0.5677	0.1721	0.069*
C7	0.43266 (13)	0.6977 (4)	0.09758 (18)	0.0716 (18)
H7	0.4727	0.6891	0.0894	0.086*
C8	0.39537 (19)	0.7832 (4)	0.06030 (14)	0.075 (2)
H8	0.4104	0.8318	0.0271	0.090*
C9	0.33558 (18)	0.7960 (4)	0.07259 (15)	0.0668 (17)
H9	0.3106	0.8533	0.0476	0.080*
C10	0.31309 (12)	0.7233 (4)	0.12215 (16)	0.0547 (14)
H10	0.2731	0.7319	0.1304	0.066*
C16	0.39374 (13)	0.5381 (3)	0.36984 (15)	0.0417 (11)
C17	0.44538 (14)	0.5143 (3)	0.40541 (15)	0.0501 (13)
H17	0.4541	0.4215	0.4203	0.060*
C18	0.48397 (12)	0.6292 (4)	0.41877 (16)	0.0584 (15)
H18	0.5185	0.6133	0.4426	0.070*
C19	0.47092 (15)	0.7679 (3)	0.39656 (18)	0.0671 (17)
H19	0.4967	0.8447	0.4055	0.081*
C20	0.41928 (17)	0.7917 (3)	0.36100 (17)	0.0654 (17)
H20	0.4105	0.8845	0.3461	0.078*
C21	0.38069 (13)	0.6768 (3)	0.34764 (15)	0.0503 (13)
H21	0.3461	0.6927	0.3238	0.060*
C22	0.35058 (15)	0.2911 (3)	0.42695 (11)	0.0381 (11)
C23	0.33064 (15)	0.3641 (3)	0.47767 (15)	0.0492 (13)
H23	0.3110	0.4527	0.4729	0.059*
C24	0.34009 (17)	0.3046 (4)	0.53554 (12)	0.0646 (16)
H24	0.3268	0.3535	0.5695	0.078*
C25	0.36947 (18)	0.1722 (4)	0.54270 (13)	0.0702 (18)
H25	0.3758	0.1324	0.5814	0.084*
C26	0.38941 (16)	0.0991 (3)	0.49198 (18)	0.0691 (18)
H26	0.4091	0.0105	0.4968	0.083*
C27	0.37996 (15)	0.1586 (3)	0.43411 (15)	0.0518 (13)
H27	0.3933	0.1098	0.4002	0.062*
C28	0.37716 (14)	0.2656 (3)	0.29846 (14)	0.0406 (11)
C29	0.43784 (14)	0.2665 (4)	0.28940 (17)	0.0656 (16)
H29	0.4626	0.3297	0.3118	0.079*
C30	0.46151 (14)	0.1729 (5)	0.24695 (19)	0.085 (2)
H30	0.5021	0.1736	0.2409	0.103*
C31	0.4245 (2)	0.0784 (4)	0.21355 (17)	0.084 (2)
H31	0.4403	0.0158	0.1852	0.100*
C32	0.3638 (2)	0.0775 (4)	0.22261 (18)	0.085 (2)
H32	0.3390	0.0143	0.2003	0.102*
C33	0.34014 (13)	0.1711 (4)	0.26506 (18)	0.0662 (17)
H33	0.2995	0.1704	0.2711	0.079*
C34	0.10755 (13)	0.2813 (4)	0.34826 (16)	0.0471 (12)
C35	0.06360 (18)	0.3827 (4)	0.35975 (18)	0.0692 (17)
H35	0.0724	0.4630	0.3844	0.083*
C36	0.00648 (16)	0.3642 (6)	0.3344 (2)	0.098 (3)
H36	−0.0229	0.4321	0.3421	0.118*
C37	−0.00669 (16)	0.2442 (7)	0.2976 (2)	0.112 (3)
H37	−0.0449	0.2318	0.2807	0.134*
C38	0.0373 (2)	0.1428 (5)	0.2861 (2)	0.110 (3)
H38	0.0285	0.0625	0.2615	0.132*
C39	0.0944 (2)	0.1614 (4)	0.31145 (19)	0.081 (2)
H39	0.1238	0.0935	0.3038	0.097*
C40	0.16695 (16)	0.4012 (3)	0.45167 (13)	0.0417 (11)
C41	0.13200 (16)	0.3307 (3)	0.49323 (16)	0.0573 (14)
H41	0.1171	0.2381	0.4846	0.069*
C42	0.11924 (18)	0.3986 (5)	0.54776 (15)	0.0769 (19)
H42	0.0959	0.3514	0.5756	0.092*
C43	0.1414 (2)	0.5370 (5)	0.56073 (15)	0.091 (2)
H43	0.1329	0.5824	0.5972	0.110*
C44	0.1764 (2)	0.6075 (4)	0.51916 (19)	0.085 (2)
H44	0.1912	0.7001	0.5278	0.102*
C45	0.18914 (16)	0.5396 (3)	0.46463 (16)	0.0554 (14)
H45	0.2125	0.5868	0.4368	0.066*
C46	0.21387 (15)	0.1359 (3)	0.39821 (14)	0.0416 (11)
C47	0.22624 (17)	0.0446 (4)	0.34983 (12)	0.0588 (15)
H47	0.2169	0.0738	0.3100	0.071*
C48	0.25250 (18)	−0.0904 (3)	0.36103 (16)	0.0685 (17)
H48	0.2608	−0.1515	0.3287	0.082*
C49	0.26641 (16)	−0.1340 (3)	0.4206 (2)	0.0686 (18)
H49	0.2840	−0.2243	0.4281	0.082*
C50	0.25405 (16)	−0.0427 (4)	0.46898 (14)	0.0599 (15)
H50	0.2633	−0.0719	0.5088	0.072*
C51	0.22778 (16)	0.0922 (3)	0.45779 (13)	0.0485 (13)
H51	0.2195	0.1533	0.4902	0.058*
O5	0.0180 (7)	0.0325 (16)	0.5073 (8)	0.143 (5)*	0.50
C52	−0.0330 (11)	0.033 (3)	0.5424 (10)	0.165 (10)*	0.50
H52A	−0.0289	−0.0314	0.5773	0.198*	0.50
H52B	−0.0686	0.0083	0.5181	0.198*	0.50
C53	−0.0324 (14)	0.190 (3)	0.5609 (13)	0.186 (11)*	0.50
H53A	−0.0655	0.2095	0.5859	0.224*	0.50
H53B	−0.0353	0.2507	0.5252	0.224*	0.50
H53C	0.0040	0.2115	0.5836	0.224*	0.50
C54	0.0247 (11)	−0.115 (2)	0.4895 (11)	0.154 (9)*	0.50
H54A	−0.0133	−0.1533	0.4742	0.185*	0.50
H54B	0.0381	−0.1731	0.5244	0.185*	0.50
C55	0.0689 (12)	−0.124 (3)	0.4409 (12)	0.174 (10)*	0.50
H55A	0.0735	−0.2236	0.4288	0.209*	0.50
H55B	0.1064	−0.0868	0.4564	0.209*	0.50
H55C	0.0552	−0.0671	0.4064	0.209*	0.50

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Pt	0.03140 (10)	0.03758 (9)	0.02984 (10)	0.00111 (8)	0.00179 (7)	0.00230 (8)
Re	0.04179 (12)	0.04866 (12)	0.02939 (10)	0.00440 (9)	−0.00239 (8)	0.00195 (8)
C11	0.061 (4)	0.092 (5)	0.052 (4)	0.001 (3)	−0.020 (3)	−0.013 (3)
C12	0.079 (5)	0.093 (4)	0.030 (3)	−0.009 (4)	0.001 (3)	−0.005 (3)
C13	0.061 (4)	0.085 (4)	0.054 (4)	0.005 (3)	−0.006 (3)	−0.027 (3)
C14	0.101 (6)	0.054 (3)	0.057 (4)	−0.008 (4)	−0.015 (4)	−0.009 (3)
C15	0.064 (4)	0.097 (5)	0.050 (4)	−0.020 (4)	−0.007 (3)	−0.004 (3)
P1	0.0319 (6)	0.0366 (6)	0.0369 (7)	0.0020 (5)	0.0011 (5)	0.0019 (5)
P2	0.0382 (7)	0.0398 (6)	0.0333 (6)	−0.0039 (5)	0.0024 (5)	0.0007 (5)
C1	0.039 (3)	0.046 (3)	0.031 (2)	0.001 (2)	0.003 (2)	0.002 (2)
C2	0.044 (3)	0.050 (3)	0.044 (3)	0.000 (2)	0.001 (2)	0.009 (2)
C3	0.042 (3)	0.065 (3)	0.046 (3)	0.008 (3)	−0.003 (3)	0.004 (3)
O3	0.067 (3)	0.097 (3)	0.055 (3)	0.024 (2)	0.015 (2)	−0.004 (2)
C4	0.081 (4)	0.063 (4)	0.031 (3)	0.016 (3)	−0.002 (3)	0.002 (3)
O4	0.175 (5)	0.048 (2)	0.063 (3)	0.010 (3)	0.000 (3)	0.005 (2)
C5	0.049 (3)	0.047 (3)	0.038 (3)	−0.013 (2)	0.005 (2)	−0.004 (2)
C6	0.056 (4)	0.071 (4)	0.047 (3)	−0.018 (3)	0.007 (3)	−0.005 (3)
C7	0.065 (4)	0.086 (5)	0.066 (4)	−0.029 (4)	0.026 (3)	−0.010 (4)
C8	0.099 (6)	0.074 (4)	0.054 (4)	−0.039 (4)	0.021 (4)	0.001 (3)
C9	0.082 (5)	0.070 (4)	0.048 (3)	−0.015 (3)	0.004 (3)	0.013 (3)
C10	0.057 (4)	0.061 (3)	0.046 (3)	−0.007 (3)	0.004 (3)	0.010 (3)
C16	0.040 (3)	0.041 (3)	0.044 (3)	−0.003 (2)	0.004 (2)	−0.004 (2)
C17	0.042 (3)	0.055 (3)	0.053 (3)	−0.005 (2)	−0.003 (3)	0.003 (3)
C18	0.043 (3)	0.070 (4)	0.061 (4)	−0.011 (3)	−0.002 (3)	−0.006 (3)
C19	0.066 (4)	0.062 (4)	0.074 (4)	−0.022 (3)	0.010 (3)	−0.019 (3)
C20	0.080 (5)	0.038 (3)	0.078 (4)	−0.005 (3)	0.000 (4)	−0.003 (3)
C21	0.049 (3)	0.041 (3)	0.060 (3)	0.005 (2)	0.002 (3)	−0.004 (2)
C22	0.037 (3)	0.037 (2)	0.040 (3)	−0.004 (2)	−0.004 (2)	0.003 (2)
C23	0.054 (3)	0.047 (3)	0.046 (3)	−0.004 (2)	−0.005 (3)	−0.002 (2)
C24	0.074 (4)	0.077 (4)	0.042 (3)	−0.016 (3)	−0.004 (3)	0.004 (3)
C25	0.073 (4)	0.077 (4)	0.059 (4)	−0.013 (4)	−0.015 (3)	0.032 (3)
C26	0.064 (4)	0.056 (3)	0.086 (5)	0.003 (3)	−0.009 (4)	0.027 (3)
C27	0.051 (3)	0.047 (3)	0.057 (3)	0.003 (2)	0.004 (3)	0.011 (3)
C28	0.040 (3)	0.043 (3)	0.039 (3)	0.009 (2)	0.003 (2)	0.005 (2)
C29	0.047 (3)	0.097 (5)	0.054 (4)	0.010 (3)	0.009 (3)	−0.006 (3)
C30	0.062 (4)	0.134 (6)	0.062 (4)	0.028 (4)	0.017 (3)	−0.007 (4)
C31	0.097 (6)	0.096 (5)	0.059 (4)	0.035 (4)	0.021 (4)	−0.010 (4)
C32	0.095 (6)	0.083 (5)	0.078 (5)	−0.003 (4)	0.009 (4)	−0.032 (4)
C33	0.058 (4)	0.066 (4)	0.076 (4)	−0.002 (3)	0.017 (3)	−0.029 (3)
C34	0.046 (3)	0.058 (3)	0.037 (3)	−0.014 (3)	0.002 (2)	0.009 (2)
C35	0.040 (3)	0.098 (5)	0.070 (4)	−0.004 (3)	−0.001 (3)	0.007 (4)
C36	0.046 (4)	0.145 (8)	0.102 (6)	−0.003 (4)	−0.007 (4)	0.032 (6)
C37	0.063 (5)	0.171 (9)	0.099 (6)	−0.053 (6)	−0.025 (5)	0.040 (6)
C38	0.095 (6)	0.142 (8)	0.091 (6)	−0.057 (6)	−0.022 (5)	−0.006 (5)
C39	0.074 (5)	0.092 (5)	0.075 (5)	−0.031 (4)	−0.011 (4)	−0.010 (4)
C40	0.042 (3)	0.047 (3)	0.036 (3)	−0.001 (2)	0.004 (2)	−0.001 (2)
C41	0.065 (4)	0.060 (3)	0.048 (3)	0.001 (3)	0.017 (3)	0.005 (3)
C42	0.077 (5)	0.106 (5)	0.050 (4)	0.011 (4)	0.023 (3)	0.007 (4)
C43	0.088 (6)	0.124 (7)	0.061 (4)	0.000 (5)	0.005 (4)	−0.042 (4)
C44	0.081 (5)	0.095 (5)	0.080 (5)	−0.015 (4)	0.017 (4)	−0.046 (4)
C45	0.055 (3)	0.057 (3)	0.054 (3)	−0.004 (3)	0.004 (3)	−0.013 (3)
C46	0.044 (3)	0.038 (3)	0.043 (3)	−0.009 (2)	0.001 (2)	0.003 (2)
C47	0.066 (4)	0.054 (3)	0.057 (4)	−0.002 (3)	0.006 (3)	−0.006 (3)
C48	0.076 (5)	0.049 (3)	0.081 (5)	0.003 (3)	0.007 (4)	−0.012 (3)
C49	0.064 (4)	0.043 (3)	0.101 (5)	0.003 (3)	0.019 (4)	0.014 (3)
C50	0.055 (4)	0.059 (3)	0.067 (4)	0.001 (3)	0.014 (3)	0.026 (3)
C51	0.053 (3)	0.047 (3)	0.046 (3)	−0.004 (2)	0.008 (3)	0.010 (2)

Geometric parameters (Å, º)

Pt—C1	2.008 (4)	C29—H29	0.9300
Pt—P1	2.2717 (12)	C30—C31	1.3900
Pt—P2	2.3753 (12)	C30—H30	0.9300
Pt—Re	2.7360 (3)	C31—C32	1.3900
Re—C4	1.883 (6)	C31—H31	0.9300
Re—C3	1.905 (6)	C32—C33	1.3900
Re—C1	2.083 (5)	C32—H32	0.9300
Re—C11	2.278 (6)	C33—H33	0.9300
Re—C12	2.294 (5)	C34—C35	1.3900
Re—C15	2.305 (6)	C34—C39	1.3900
Re—C13	2.322 (6)	C35—C36	1.3900
Re—C14	2.327 (6)	C35—H35	0.9300
C11—C12	1.382 (8)	C36—C37	1.3900
C11—C15	1.424 (9)	C36—H36	0.9300
C11—H11	0.9300	C37—C38	1.3900
C12—C13	1.411 (9)	C37—H37	0.9300
C12—H12	0.9300	C38—C39	1.3900
C13—C14	1.391 (9)	C38—H38	0.9300
C13—H13	0.9300	C39—H39	0.9300
C14—C15	1.398 (9)	C40—C41	1.3900
C14—H14	0.9300	C40—C45	1.3900
C15—H15	0.9300	C41—C42	1.3900
P1—C22	1.841 (3)	C41—H41	0.9300
P1—C28	1.850 (3)	C42—C43	1.3900
P1—C16	1.866 (3)	C42—H42	0.9300
P2—C40	1.827 (3)	C43—C44	1.3900
P2—C46	1.849 (3)	C43—H43	0.9300
P2—C34	1.865 (3)	C44—C45	1.3900
C1—C2	1.351 (6)	C44—H44	0.9300
C2—C5	1.497 (5)	C45—H45	0.9300
C2—H2	0.9300	C46—C47	1.3900
C3—O3	1.163 (6)	C46—C51	1.3900
C4—O4	1.171 (6)	C47—C48	1.3900
C5—C6	1.3900	C47—H47	0.9300
C5—C10	1.3900	C48—C49	1.3900
C6—C7	1.3900	C48—H48	0.9300
C6—H6	0.9300	C49—C50	1.3900
C7—C8	1.3900	C49—H49	0.9300
C7—H7	0.9300	C50—C51	1.3900
C8—C9	1.3900	C50—H50	0.9300
C8—H8	0.9300	C51—H51	0.9300
C9—C10	1.3900	O5—O5^i	1.05 (3)
C9—H9	0.9300	O5—C54^i	1.23 (3)
C10—H10	0.9300	O5—C52^i	1.30 (3)
C16—C17	1.3900	O5—C52	1.409 (10)
C16—C21	1.3900	O5—C54	1.420 (10)
C17—C18	1.3900	C52—C54^i	1.05 (3)
C17—H17	0.9300	C52—C55^i	1.23 (3)
C18—C19	1.3900	C52—O5^i	1.30 (3)
C18—H18	0.9300	C52—C53	1.498 (10)
C19—C20	1.3900	C52—H52A	0.97 (3)
C19—H19	0.9300	C52—H52B	0.97 (3)
C20—C21	1.3900	C53—C55^i	1.02 (3)
C20—H20	0.9300	C53—C54^i	1.32 (3)
C21—H21	0.9300	C53—H53A	0.96 (3)
C22—C23	1.3900	C53—H53B	0.96 (3)
C22—C27	1.3900	C53—H53C	0.96 (3)
C23—C24	1.3900	C54—C52^i	1.05 (3)
C23—H23	0.9300	C54—O5^i	1.23 (3)
C24—C25	1.3900	C54—C53^i	1.32 (3)
C24—H24	0.9300	C54—C55	1.491 (10)
C25—C26	1.3900	C54—H54A	0.97 (3)
C25—H25	0.9300	C54—H54B	0.97 (2)
C26—C27	1.3900	C55—C53^i	1.02 (3)
C26—H26	0.9300	C55—C52^i	1.23 (3)
C27—H27	0.9300	C55—H55A	0.96 (3)
C28—C29	1.3900	C55—H55B	0.96 (3)
C28—C33	1.3900	C55—H55C	0.96 (3)
C29—C30	1.3900
C1—Pt—P1	95.99 (14)	C26—C25—C24	120.0
C1—Pt—P2	158.97 (14)	C26—C25—H25	120.0
P1—Pt—P2	102.99 (4)	C24—C25—H25	120.0
C1—Pt—Re	49.21 (14)	C25—C26—C27	120.0
P1—Pt—Re	144.89 (3)	C25—C26—H26	120.0
P2—Pt—Re	110.78 (3)	C27—C26—H26	120.0
C4—Re—C3	81.2 (2)	C26—C27—C22	120.0
C4—Re—C1	87.6 (2)	C26—C27—H27	120.0
C3—Re—C1	104.0 (2)	C22—C27—H27	120.0
C4—Re—C11	103.0 (2)	C29—C28—C33	120.0
C3—Re—C11	111.8 (2)	C29—C28—P1	123.8 (2)
C1—Re—C11	143.8 (2)	C33—C28—P1	116.2 (2)
C4—Re—C12	99.4 (2)	C30—C29—C28	120.0
C3—Re—C12	146.6 (2)	C30—C29—H29	120.0
C1—Re—C12	109.4 (2)	C28—C29—H29	120.0
C11—Re—C12	35.2 (2)	C29—C30—C31	120.0
C4—Re—C15	135.1 (3)	C29—C30—H30	120.0
C3—Re—C15	96.8 (2)	C31—C30—H30	120.0
C1—Re—C15	135.2 (2)	C32—C31—C30	120.0
C11—Re—C15	36.2 (2)	C32—C31—H31	120.0
C12—Re—C15	59.2 (2)	C30—C31—H31	120.0
C4—Re—C13	126.6 (2)	C31—C32—C33	120.0
C3—Re—C13	151.2 (2)	C31—C32—H32	120.0
C1—Re—C13	86.5 (2)	C33—C32—H32	120.0
C11—Re—C13	59.2 (2)	C32—C33—C28	120.0
C12—Re—C13	35.6 (2)	C32—C33—H33	120.0
C15—Re—C13	59.1 (2)	C28—C33—H33	120.0
C4—Re—C14	157.6 (2)	C35—C34—C39	120.0
C3—Re—C14	116.4 (2)	C35—C34—P2	118.0 (2)
C1—Re—C14	100.4 (2)	C39—C34—P2	121.8 (2)
C11—Re—C14	58.8 (2)	C34—C35—C36	120.0
C12—Re—C14	58.3 (2)	C34—C35—H35	120.0
C15—Re—C14	35.1 (2)	C36—C35—H35	120.0
C13—Re—C14	34.8 (2)	C37—C36—C35	120.0
C4—Re—Pt	111.49 (16)	C37—C36—H36	120.0
C3—Re—Pt	69.14 (15)	C35—C36—H36	120.0
C1—Re—Pt	46.87 (12)	C36—C37—C38	120.0
C11—Re—Pt	145.02 (18)	C36—C37—H37	120.0
C12—Re—Pt	137.67 (18)	C38—C37—H37	120.0
C15—Re—Pt	109.39 (17)	C39—C38—C37	120.0
C13—Re—Pt	102.23 (17)	C39—C38—H38	120.0
C14—Re—Pt	88.66 (16)	C37—C38—H38	120.0
C12—C11—C15	108.1 (6)	C38—C39—C34	120.0
C12—C11—Re	73.0 (3)	C38—C39—H39	120.0
C15—C11—Re	72.9 (3)	C34—C39—H39	120.0
C12—C11—H11	126.0	C41—C40—C45	120.0
C15—C11—H11	126.0	C41—C40—P2	122.15 (19)
Re—C11—H11	119.9	C45—C40—P2	117.85 (19)
C11—C12—C13	108.8 (6)	C42—C41—C40	120.0
C11—C12—Re	71.8 (3)	C42—C41—H41	120.0
C13—C12—Re	73.3 (3)	C40—C41—H41	120.0
C11—C12—H12	125.6	C41—C42—C43	120.0
C13—C12—H12	125.6	C41—C42—H42	120.0
Re—C12—H12	121.1	C43—C42—H42	120.0
C14—C13—C12	106.9 (6)	C44—C43—C42	120.0
C14—C13—Re	72.8 (3)	C44—C43—H43	120.0
C12—C13—Re	71.1 (3)	C42—C43—H43	120.0
C14—C13—H13	126.6	C43—C44—C45	120.0
C12—C13—H13	126.6	C43—C44—H44	120.0
Re—C13—H13	121.3	C45—C44—H44	120.0
C13—C14—C15	109.6 (6)	C44—C45—C40	120.0
C13—C14—Re	72.4 (3)	C44—C45—H45	120.0
C15—C14—Re	71.6 (4)	C40—C45—H45	120.0
C13—C14—H14	125.2	C47—C46—C51	120.0
C15—C14—H14	125.2	C47—C46—P2	116.98 (19)
Re—C14—H14	122.5	C51—C46—P2	122.84 (19)
C14—C15—C11	106.5 (6)	C46—C47—C48	120.0
C14—C15—Re	73.3 (4)	C46—C47—H47	120.0
C11—C15—Re	70.9 (3)	C48—C47—H47	120.0
C14—C15—H15	126.7	C49—C48—C47	120.0
C11—C15—H15	126.7	C49—C48—H48	120.0
Re—C15—H15	120.9	C47—C48—H48	120.0
C22—P1—C28	104.41 (16)	C50—C49—C48	120.0
C22—P1—C16	97.46 (15)	C50—C49—H49	120.0
C28—P1—C16	105.92 (16)	C48—C49—H49	120.0
C22—P1—Pt	121.31 (12)	C49—C50—C51	120.0
C28—P1—Pt	108.92 (12)	C49—C50—H50	120.0
C16—P1—Pt	117.11 (11)	C51—C50—H50	120.0
C40—P2—C46	105.26 (16)	C50—C51—C46	120.0
C40—P2—C34	99.07 (17)	C50—C51—H51	120.0
C46—P2—C34	103.43 (17)	C46—C51—H51	120.0
C40—P2—Pt	118.61 (11)	O5^i—O5—C54^i	76.8 (16)
C46—P2—Pt	111.27 (12)	O5^i—O5—C52^i	72.8 (14)
C34—P2—Pt	117.32 (13)	C54^i—O5—C52^i	124 (2)
C2—C1—Pt	133.5 (4)	O5^i—O5—C52	62.1 (16)
C2—C1—Re	141.6 (4)	C54^i—O5—C52	46.2 (14)
Pt—C1—Re	83.92 (17)	C52^i—O5—C52	134.8 (13)
C1—C2—C5	132.0 (4)	O5^i—O5—C54	57.4 (15)
C1—C2—H2	114.0	C54^i—O5—C54	134.2 (13)
C5—C2—H2	114.0	C52^i—O5—C54	45.0 (13)
O3—C3—Re	171.5 (5)	C52—O5—C54	104.7 (15)
O4—C4—Re	177.6 (6)	C54^i—C52—O5^i	73.4 (16)
C6—C5—C10	120.0	C55^i—C52—O5^i	140 (3)
C6—C5—C2	116.2 (3)	C55^i—C52—O5	137 (3)
C10—C5—C2	123.7 (3)	O5^i—C52—C53	132 (2)
C5—C6—C7	120.0	O5—C52—C53	99 (2)
C5—C6—H6	120.0	C54^i—C52—H52A	162 (3)
C7—C6—H6	120.0	C55^i—C52—H52A	103 (2)
C8—C7—C6	120.0	O5^i—C52—H52A	111 (2)
C8—C7—H7	120.0	O5—C52—H52A	112 (2)
C6—C7—H7	120.0	C53—C52—H52A	112 (2)
C9—C8—C7	120.0	C54^i—C52—H52B	88 (3)
C9—C8—H8	120.0	C55^i—C52—H52B	78 (2)
C7—C8—H8	120.0	O5^i—C52—H52B	70.8 (15)
C8—C9—C10	120.0	O5—C52—H52B	112.0 (19)
C8—C9—H9	120.0	C53—C52—H52B	112 (2)
C10—C9—H9	120.0	H52A—C52—H52B	110 (2)
C9—C10—C5	120.0	C54^i—C53—H53A	135 (3)
C9—C10—H10	120.0	C52—C53—H53A	109 (2)
C5—C10—H10	120.0	C55^i—C53—H53B	107 (3)
C17—C16—C21	120.0	C52—C53—H53B	109 (2)
C17—C16—P1	120.38 (18)	H53A—C53—H53B	109 (3)
C21—C16—P1	119.60 (18)	C55^i—C53—H53C	144 (4)
C16—C17—C18	120.0	C54^i—C53—H53C	114 (3)
C16—C17—H17	120.0	C52—C53—H53C	109 (3)
C18—C17—H17	120.0	H53A—C53—H53C	109 (3)
C17—C18—C19	120.0	H53B—C53—H53C	109 (3)
C17—C18—H18	120.0	O5^i—C54—C53^i	120 (3)
C19—C18—H18	120.0	C53^i—C54—O5	138 (2)
C20—C19—C18	120.0	O5^i—C54—C55	129 (2)
C20—C19—H19	120.0	O5—C54—C55	109 (2)
C18—C19—H19	120.0	C52^i—C54—H54A	102 (3)
C19—C20—C21	120.0	O5—C54—H54A	109.8 (17)
C19—C20—H20	120.0	C55—C54—H54A	110 (2)
C21—C20—H20	120.0	O5^i—C54—H54B	121 (2)
C20—C21—C16	120.0	C53^i—C54—H54B	109.0 (18)
C20—C21—H21	120.0	O5—C54—H54B	109.8 (19)
C16—C21—H21	120.0	C55—C54—H54B	110 (2)
C23—C22—C27	120.0	H54A—C54—H54B	108 (2)
C23—C22—P1	116.39 (19)	C54—C55—H55A	109 (2)
C27—C22—P1	123.46 (19)	C52^i—C55—H55B	104 (3)
C24—C23—C22	120.0	C54—C55—H55B	109 (3)
C24—C23—H23	120.0	H55A—C55—H55B	109 (3)
C22—C23—H23	120.0	C54—C55—H55C	109 (2)
C25—C24—C23	120.0	H55A—C55—H55C	109 (3)
C25—C24—H24	120.0	H55B—C55—H55C	109 (3)
C23—C24—H24	120.0

Symmetry code: (i) −x, −y, −z+1.