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The Ru atom in the title compound, [RuCl2{P(C6H5)3}2{C6H4(NH)2}]·1.33CH3OH·0.33CH2Cl2, shows a six-coordinate octahedral geometry, with a trans arrangement of the tri­phenyl­phosphine groups. One and a half mol­ecules of complex, two mol­ecules of methanol and a half mol­ecule of di­chloro­methane form the asymmetric unit, with crystallographic twofold rotation symmetry for the complex mol­ecule in a special position.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S0108270100006144/qa0217sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S0108270100006144/qa0217Isup2.hkl
Contains datablock I

CCDC reference: 146087

Computing details top

Data collection: KappaCCD Server Software (Nonius, 1997); cell refinement: DENZO-SMN (Otwinowski & Minor, 1997); data reduction: DENZO-SMN; program(s) used to solve structure: SHELXTL (Sheldrick, 1997); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL.

ο-benzoquinonediimine-dichloro-bis(triphenylphosphine)ruthenium(II) top
Crystal data top
[RuCl2(C18H15P)2(C6H6N2)]·1.33CH4O·0.33CH2Cl2F(000) = 5208
Mr = 873.67Dx = 1.446 Mg m3
Monoclinic, C2/cMo Kα radiation, λ = 0.71073 Å
a = 47.7172 (11) ÅCell parameters from 39381 reflections
b = 10.3463 (2) Åθ = 4.1–26.4°
c = 33.7261 (8) ŵ = 0.69 mm1
β = 133.694 (8)°T = 150 K
V = 12038.9 (5) Å3Prism, purple
Z = 120.35 × 0.26 × 0.24 mm
Data collection top
KappaCCD
diffractometer
12170 independent reflections
Radiation source: fine-focus sealed tube8058 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.067
φ and ω scans with κ offsetsθmax = 26.4°, θmin = 4.1°
Absorption correction: multi-scan
(DENZO-SMN; Otwinowski & Minor, 1997)
h = 059
Tmin = 0.807, Tmax = 0.862k = 012
39381 measured reflectionsl = 4230
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)] = 0.041Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.106H-atom parameters constrained
S = 0.99 w = 1/[σ2(Fo2) + (0.0516P)2]
where P = (Fo2 + 2Fc2)/3
12170 reflections(Δ/σ)max = 0.001
701 parametersΔρmax = 0.84 e Å3
0 restraintsΔρmin = 0.50 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
Ru1A0.806441 (8)0.14175 (2)0.396487 (12)0.01660 (8)
Cl1A0.83308 (3)0.28208 (8)0.47384 (4)0.0269 (2)
Cl2A0.78152 (3)0.31154 (8)0.32901 (4)0.0263 (2)
P1A0.74687 (2)0.14053 (8)0.37526 (4)0.0187 (2)
P2A0.86792 (3)0.14773 (8)0.42348 (4)0.0185 (2)
N1A0.82237 (8)0.0179 (2)0.43993 (12)0.0199 (7)
H1AA0.83580.01470.47520.024*
N2A0.78661 (8)0.0054 (2)0.34154 (12)0.0196 (7)
H2AA0.77480.02530.30770.024*
C1A0.81215 (10)0.1297 (3)0.41406 (15)0.0228 (8)
C2A0.79150 (10)0.1162 (3)0.35685 (15)0.0219 (8)
C3A0.77892 (11)0.2290 (3)0.32409 (18)0.0333 (10)
H3AA0.76540.22220.28640.040*
C4A0.78658 (12)0.3464 (3)0.3477 (2)0.0411 (12)
H4AA0.77790.42190.32590.049*
C5A0.80727 (11)0.3599 (4)0.40417 (19)0.0381 (11)
H5AA0.81230.44410.41910.046*
C6A0.81998 (10)0.2556 (3)0.43732 (17)0.0294 (9)
H6AA0.83370.26610.47490.035*
C11A0.70766 (10)0.0513 (3)0.31265 (15)0.0232 (8)
C12A0.70055 (11)0.0775 (4)0.26583 (16)0.0309 (9)
H12A0.71570.14080.26730.037*
C13A0.67205 (12)0.0133 (4)0.21777 (18)0.0480 (12)
H13A0.66760.03230.18620.058*
C14A0.64998 (13)0.0779 (5)0.2148 (2)0.0566 (14)
H14A0.63080.12390.18150.068*
C15A0.65529 (12)0.1038 (4)0.25979 (19)0.0472 (12)
H15A0.63950.16600.25730.057*
C16A0.68385 (10)0.0384 (4)0.30865 (17)0.0364 (10)
H16A0.68720.05450.33950.044*
C21A0.75470 (9)0.0611 (3)0.43008 (14)0.0213 (8)
C22A0.75663 (10)0.0757 (3)0.43461 (16)0.0271 (9)
H22A0.75030.12710.40600.033*
C23A0.76757 (10)0.1347 (4)0.48028 (16)0.0292 (9)
H23A0.76870.22630.48280.035*
C24A0.77681 (10)0.0623 (4)0.52222 (16)0.0320 (9)
H24A0.78380.10370.55320.038*
C25A0.77579 (10)0.0717 (4)0.51900 (16)0.0318 (9)
H25A0.78260.12240.54810.038*
C26A0.76477 (10)0.1318 (3)0.47293 (15)0.0254 (8)
H26A0.76420.22350.47110.031*
C31A0.72172 (10)0.2896 (3)0.36456 (14)0.0225 (8)
C32A0.68496 (11)0.2817 (4)0.34522 (15)0.0314 (9)
H32A0.67380.19960.33940.038*
C33A0.66449 (12)0.3935 (4)0.33430 (17)0.0425 (11)
H33A0.63940.38750.32130.051*
C34A0.68055 (13)0.5140 (4)0.34238 (18)0.0441 (12)
H34A0.66620.59020.33410.053*
C35A0.71725 (13)0.5229 (4)0.36247 (17)0.0405 (11)
H35A0.72840.60520.36830.049*
C36A0.73814 (12)0.4097 (3)0.37432 (16)0.0323 (10)
H36A0.76370.41580.38920.039*
C41A0.90721 (10)0.0760 (3)0.49074 (15)0.0204 (8)
C42A0.90831 (10)0.0558 (3)0.49983 (16)0.0268 (9)
H42A0.88900.11100.47020.032*
C43A0.93738 (11)0.1072 (4)0.55177 (18)0.0380 (11)
H43A0.93760.19730.55740.046*
C44A0.96620 (11)0.0289 (4)0.59565 (17)0.0409 (11)
H44A0.98640.06510.63100.049*
C45A0.96522 (12)0.1021 (4)0.58730 (17)0.0361 (10)
H45A0.98470.15690.61700.043*
C46A0.93558 (10)0.1538 (4)0.53526 (15)0.0275 (9)
H46A0.93470.24450.53010.033*
C51A0.88941 (10)0.3010 (3)0.42790 (14)0.0217 (8)
C52A0.92033 (11)0.2991 (4)0.43215 (16)0.0330 (10)
H52A0.92970.21900.43130.040*
C53A0.93799 (12)0.4147 (4)0.43772 (18)0.0456 (12)
H53A0.95920.41320.44050.055*
C54A0.92462 (13)0.5303 (4)0.43919 (18)0.0460 (12)
H54A0.93660.60890.44290.055*
C55A0.89423 (12)0.5327 (4)0.43531 (17)0.0390 (11)
H55A0.88520.61300.43660.047*
C56A0.87637 (11)0.4189 (3)0.42956 (15)0.0290 (9)
H56A0.85520.42160.42670.035*
C61A0.86493 (10)0.0565 (3)0.37419 (15)0.0245 (8)
C62A0.83690 (11)0.0964 (4)0.32007 (17)0.0379 (10)
H62A0.82270.17330.31130.046*
C63A0.82927 (13)0.0263 (5)0.27870 (19)0.0506 (13)
H63A0.81040.05660.24200.061*
C64A0.84874 (16)0.0866 (5)0.2901 (2)0.0554 (14)
H64A0.84280.13610.26140.066*
C65A0.87627 (17)0.1264 (4)0.3424 (2)0.0607 (15)
H65A0.88990.20420.35030.073*
C66A0.88549 (13)0.0553 (4)0.38588 (19)0.0436 (11)
H66A0.90550.08370.42270.052*
Ru1B1.00000.38941 (3)0.25000.01552 (10)
N1B0.97292 (8)0.5383 (2)0.19882 (12)0.0188 (6)
H1BA0.95400.52690.16320.023*
Cl1B0.96098 (2)0.23415 (7)0.17459 (4)0.0219 (2)
P1B0.95256 (3)0.37937 (8)0.25557 (4)0.0187 (2)
C1B0.98452 (9)0.6553 (3)0.22046 (14)0.0180 (8)
C5B0.98505 (10)0.8864 (3)0.22077 (16)0.0282 (9)
H5B0.97580.96650.20170.034*
C6B0.96959 (10)0.7749 (3)0.19181 (15)0.0240 (8)
H6BA0.94910.77660.15300.029*
C11B0.96279 (10)0.4843 (3)0.30807 (16)0.0238 (8)
C12B0.99965 (11)0.4741 (3)0.36117 (16)0.0288 (9)
H12B1.01880.42200.36760.035*
C13B1.00832 (13)0.5390 (4)0.40417 (18)0.0408 (11)
H13B1.03340.53120.44000.049*
C14B0.98081 (15)0.6152 (4)0.3956 (2)0.0480 (13)
H14B0.98710.66000.42540.058*
C15B0.94454 (15)0.6263 (4)0.3441 (2)0.0449 (12)
H15B0.92570.67890.33840.054*
C16B0.93496 (12)0.5608 (3)0.29976 (18)0.0336 (10)
H16B0.90970.56840.26420.040*
C21B0.90452 (10)0.4264 (3)0.19137 (15)0.0237 (8)
C22B0.89710 (11)0.5571 (3)0.17429 (17)0.0310 (9)
H22B0.91630.62090.19790.037*
C23B0.86160 (12)0.5925 (4)0.12287 (19)0.0424 (11)
H23B0.85650.68060.11180.051*
C24B0.83394 (11)0.4990 (4)0.08810 (18)0.0447 (12)
H24B0.80990.52300.05300.054*
C25B0.84092 (11)0.3721 (4)0.10398 (18)0.0411 (11)
H25B0.82170.30870.07990.049*
C26B0.87616 (10)0.3354 (4)0.15537 (16)0.0305 (9)
H26B0.88080.24690.16580.037*
C31B0.94397 (9)0.2243 (3)0.27285 (14)0.0200 (8)
C32B0.93407 (10)0.2228 (3)0.30343 (15)0.0283 (9)
H32B0.93300.30130.31690.034*
C33B0.92590 (11)0.1062 (3)0.31400 (17)0.0341 (10)
H33B0.91860.10510.33400.041*
C34B0.92843 (11)0.0095 (4)0.29531 (17)0.0345 (10)
H34B0.92310.08930.30290.041*
C35B0.93858 (10)0.0078 (3)0.26605 (16)0.0317 (10)
H35B0.94020.08660.25330.038*
C36B0.94650 (10)0.1090 (3)0.25468 (15)0.0250 (9)
H36B0.95360.10930.23450.030*
O1S0.91048 (7)0.5748 (2)0.07668 (11)0.0375 (7)
H1S0.89530.63470.05540.056*
O2S0.87164 (8)0.1094 (3)0.56545 (13)0.0539 (9)
H2S0.89220.15250.58400.081*
C1S0.89201 (12)0.4535 (3)0.05246 (17)0.0398 (11)
H1S10.89430.42890.02680.060*
H1S20.86450.46040.03270.060*
H1S30.90440.38770.08120.060*
C2S0.87957 (13)0.0112 (4)0.5907 (2)0.0596 (14)
H2S10.88510.00070.62430.089*
H2S20.85700.06810.56550.089*
H2S30.90210.05040.59970.089*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ru1A0.01715 (15)0.01440 (14)0.01583 (16)0.00005 (11)0.01047 (13)0.00039 (11)
Cl1A0.0270 (5)0.0263 (5)0.0214 (5)0.0053 (4)0.0144 (4)0.0079 (4)
Cl2A0.0317 (5)0.0193 (4)0.0242 (5)0.0031 (4)0.0180 (5)0.0050 (4)
P1A0.0167 (5)0.0206 (5)0.0157 (5)0.0006 (4)0.0100 (4)0.0009 (4)
P2A0.0174 (5)0.0191 (4)0.0178 (5)0.0013 (4)0.0117 (4)0.0003 (4)
N1A0.0205 (16)0.0194 (15)0.0210 (18)0.0009 (12)0.0148 (15)0.0000 (12)
N2A0.0191 (15)0.0198 (15)0.0199 (17)0.0021 (12)0.0134 (14)0.0015 (12)
C1A0.0164 (18)0.0190 (19)0.033 (2)0.0001 (15)0.0171 (18)0.0019 (16)
C2A0.0185 (18)0.0217 (19)0.027 (2)0.0024 (15)0.0163 (18)0.0038 (16)
C3A0.032 (2)0.026 (2)0.039 (3)0.0056 (17)0.023 (2)0.0135 (18)
C4A0.039 (2)0.015 (2)0.061 (3)0.0068 (18)0.031 (3)0.014 (2)
C5A0.036 (2)0.018 (2)0.055 (3)0.0003 (18)0.029 (2)0.004 (2)
C6A0.026 (2)0.022 (2)0.036 (3)0.0058 (17)0.020 (2)0.0094 (17)
C11A0.0137 (18)0.029 (2)0.019 (2)0.0030 (15)0.0083 (17)0.0027 (16)
C12A0.023 (2)0.041 (2)0.021 (2)0.0024 (17)0.0121 (19)0.0013 (18)
C13A0.030 (2)0.073 (3)0.026 (3)0.001 (2)0.014 (2)0.007 (2)
C14A0.032 (3)0.072 (3)0.035 (3)0.008 (2)0.011 (2)0.030 (3)
C15A0.024 (2)0.055 (3)0.041 (3)0.013 (2)0.014 (2)0.013 (2)
C16A0.021 (2)0.047 (2)0.032 (3)0.0071 (19)0.014 (2)0.008 (2)
C21A0.0155 (18)0.029 (2)0.019 (2)0.0000 (15)0.0120 (17)0.0001 (15)
C22A0.027 (2)0.029 (2)0.026 (2)0.0020 (16)0.0189 (19)0.0020 (17)
C23A0.029 (2)0.031 (2)0.033 (2)0.0027 (17)0.023 (2)0.0062 (18)
C24A0.028 (2)0.047 (2)0.026 (2)0.0122 (19)0.020 (2)0.0130 (19)
C25A0.026 (2)0.046 (2)0.019 (2)0.0070 (18)0.0142 (19)0.0005 (18)
C26A0.0219 (19)0.029 (2)0.019 (2)0.0045 (16)0.0119 (17)0.0034 (16)
C31A0.022 (2)0.031 (2)0.013 (2)0.0066 (16)0.0111 (17)0.0007 (15)
C32A0.028 (2)0.043 (2)0.020 (2)0.0091 (18)0.0150 (19)0.0021 (17)
C33A0.033 (2)0.065 (3)0.025 (2)0.023 (2)0.018 (2)0.006 (2)
C34A0.056 (3)0.049 (3)0.032 (3)0.031 (2)0.032 (3)0.013 (2)
C35A0.060 (3)0.030 (2)0.039 (3)0.012 (2)0.037 (3)0.0078 (19)
C36A0.037 (2)0.031 (2)0.032 (2)0.0112 (19)0.025 (2)0.0024 (18)
C41A0.0174 (18)0.0233 (19)0.026 (2)0.0007 (15)0.0172 (18)0.0022 (15)
C42A0.0183 (19)0.026 (2)0.034 (2)0.0022 (16)0.0177 (19)0.0025 (17)
C43A0.026 (2)0.036 (2)0.044 (3)0.0039 (19)0.022 (2)0.015 (2)
C44A0.023 (2)0.063 (3)0.028 (3)0.005 (2)0.014 (2)0.018 (2)
C45A0.036 (2)0.043 (2)0.024 (2)0.0041 (19)0.019 (2)0.0021 (19)
C46A0.027 (2)0.032 (2)0.025 (2)0.0010 (17)0.0186 (19)0.0012 (17)
C51A0.0184 (19)0.0250 (19)0.013 (2)0.0065 (15)0.0076 (17)0.0015 (15)
C52A0.027 (2)0.036 (2)0.032 (3)0.0008 (18)0.019 (2)0.0069 (18)
C53A0.034 (2)0.057 (3)0.039 (3)0.011 (2)0.023 (2)0.011 (2)
C54A0.047 (3)0.037 (3)0.040 (3)0.018 (2)0.024 (2)0.001 (2)
C55A0.044 (3)0.029 (2)0.033 (3)0.0095 (19)0.023 (2)0.0017 (18)
C56A0.033 (2)0.025 (2)0.024 (2)0.0070 (17)0.018 (2)0.0014 (16)
C61A0.025 (2)0.031 (2)0.022 (2)0.0058 (17)0.0179 (19)0.0044 (16)
C62A0.032 (2)0.053 (3)0.031 (3)0.002 (2)0.022 (2)0.001 (2)
C63A0.048 (3)0.081 (4)0.028 (3)0.011 (3)0.028 (3)0.014 (2)
C64A0.080 (4)0.066 (3)0.050 (4)0.023 (3)0.056 (3)0.025 (3)
C65A0.096 (4)0.047 (3)0.081 (5)0.009 (3)0.077 (4)0.008 (3)
C66A0.053 (3)0.046 (3)0.044 (3)0.012 (2)0.038 (3)0.002 (2)
Ru1B0.0146 (2)0.0132 (2)0.0149 (2)0.0000.00868 (18)0.000
N1B0.0160 (15)0.0187 (15)0.0153 (17)0.0007 (12)0.0084 (14)0.0014 (12)
Cl1B0.0234 (5)0.0174 (4)0.0188 (5)0.0021 (3)0.0122 (4)0.0030 (3)
P1B0.0183 (5)0.0172 (5)0.0201 (5)0.0008 (4)0.0131 (4)0.0005 (4)
C1B0.0167 (17)0.0186 (18)0.020 (2)0.0012 (14)0.0131 (16)0.0020 (14)
C5B0.032 (2)0.0151 (18)0.041 (2)0.0002 (16)0.026 (2)0.0024 (16)
C6B0.027 (2)0.0230 (19)0.020 (2)0.0031 (16)0.0154 (18)0.0031 (15)
C11B0.030 (2)0.0207 (19)0.033 (2)0.0058 (16)0.027 (2)0.0036 (16)
C12B0.032 (2)0.032 (2)0.031 (2)0.0055 (17)0.025 (2)0.0021 (17)
C13B0.048 (3)0.047 (3)0.038 (3)0.022 (2)0.034 (2)0.017 (2)
C14B0.078 (4)0.045 (3)0.054 (3)0.028 (3)0.058 (3)0.026 (2)
C15B0.072 (3)0.033 (2)0.068 (4)0.001 (2)0.063 (3)0.006 (2)
C16B0.042 (2)0.028 (2)0.043 (3)0.0016 (19)0.034 (2)0.0020 (19)
C21B0.0210 (19)0.0260 (19)0.025 (2)0.0033 (16)0.0164 (18)0.0032 (16)
C22B0.028 (2)0.031 (2)0.038 (3)0.0069 (17)0.024 (2)0.0072 (18)
C23B0.034 (2)0.046 (3)0.046 (3)0.021 (2)0.027 (2)0.022 (2)
C24B0.019 (2)0.072 (3)0.031 (3)0.016 (2)0.012 (2)0.010 (2)
C25B0.023 (2)0.052 (3)0.033 (3)0.001 (2)0.014 (2)0.006 (2)
C26B0.022 (2)0.034 (2)0.029 (2)0.0012 (17)0.0148 (19)0.0012 (17)
C31B0.0093 (17)0.0227 (19)0.019 (2)0.0010 (14)0.0064 (16)0.0016 (15)
C32B0.025 (2)0.029 (2)0.028 (2)0.0008 (17)0.017 (2)0.0028 (17)
C33B0.036 (2)0.038 (2)0.034 (3)0.0008 (19)0.027 (2)0.0109 (19)
C34B0.028 (2)0.027 (2)0.041 (3)0.0017 (17)0.021 (2)0.0131 (18)
C35B0.028 (2)0.025 (2)0.034 (3)0.0015 (17)0.018 (2)0.0024 (17)
C36B0.0201 (19)0.0216 (19)0.030 (2)0.0020 (15)0.0162 (18)0.0008 (16)
O1S0.0308 (15)0.0284 (14)0.0241 (16)0.0011 (12)0.0079 (13)0.0028 (12)
O2S0.0413 (18)0.064 (2)0.042 (2)0.0079 (16)0.0231 (17)0.0038 (16)
C1S0.041 (2)0.030 (2)0.030 (3)0.0025 (19)0.017 (2)0.0047 (18)
C2S0.047 (3)0.051 (3)0.046 (3)0.003 (2)0.019 (3)0.000 (2)
Geometric parameters (Å, º) top
Ru1A—N2A1.974 (3)C51A—C56A1.388 (5)
Ru1A—N1A1.979 (3)C52A—C53A1.399 (5)
Ru1A—P2A2.3976 (9)C53A—C54A1.372 (6)
Ru1A—P1A2.4042 (9)C54A—C55A1.363 (6)
Ru1A—Cl2A2.4372 (9)C55A—C56A1.386 (5)
Ru1A—Cl1A2.4389 (9)C61A—C62A1.385 (5)
P1A—C21A1.811 (4)C61A—C66A1.386 (5)
P1A—C31A1.830 (3)C62A—C63A1.380 (6)
P1A—C11A1.831 (4)C63A—C64A1.372 (6)
P2A—C41A1.826 (4)C64A—C65A1.343 (7)
P2A—C61A1.829 (4)C65A—C66A1.413 (6)
P2A—C51A1.838 (3)Ru1B—N1B1.985 (3)
N1A—C1A1.322 (4)Ru1B—N1Bi1.985 (3)
N2A—C2A1.318 (4)Ru1B—P1Bi2.3996 (9)
C1A—C6A1.431 (5)Ru1B—P1B2.3996 (9)
C1A—C2A1.445 (5)Ru1B—Cl1B2.4440 (9)
C2A—C3A1.424 (5)Ru1B—Cl1Bi2.4440 (9)
C3A—C4A1.356 (5)N1B—C1B1.321 (4)
C4A—C5A1.422 (6)P1B—C21B1.822 (4)
C5A—C6A1.358 (5)P1B—C11B1.832 (4)
C11A—C12A1.393 (5)P1B—C31B1.847 (3)
C11A—C16A1.399 (5)C1B—C6B1.422 (4)
C12A—C13A1.369 (5)C1B—C1Bi1.444 (7)
C13A—C14A1.365 (6)C5B—C6B1.354 (5)
C14A—C15A1.382 (7)C5B—C5Bi1.427 (8)
C15A—C16A1.389 (5)C11B—C12B1.400 (5)
C21A—C26A1.377 (5)C11B—C16B1.398 (5)
C21A—C22A1.420 (5)C12B—C13B1.377 (5)
C22A—C23A1.381 (5)C13B—C14B1.380 (6)
C23A—C24A1.376 (5)C14B—C15B1.368 (6)
C24A—C25A1.389 (5)C15B—C16B1.400 (6)
C25A—C26A1.396 (5)C21B—C26B1.386 (5)
C31A—C36A1.382 (5)C21B—C22B1.416 (5)
C31A—C32A1.389 (5)C22B—C23B1.397 (5)
C32A—C33A1.389 (5)C23B—C24B1.384 (6)
C33A—C34A1.388 (6)C24B—C25B1.369 (5)
C34A—C35A1.377 (6)C25B—C26B1.396 (5)
C35A—C36A1.405 (5)C31B—C36B1.384 (5)
C41A—C46A1.388 (5)C31B—C32B1.400 (5)
C41A—C42A1.391 (4)C32B—C33B1.388 (5)
C42A—C43A1.385 (5)C33B—C34B1.396 (5)
C43A—C44A1.388 (6)C34B—C35B1.367 (5)
C44A—C45A1.378 (5)C35B—C36B1.396 (5)
C45A—C46A1.392 (5)O1S—C1S1.423 (4)
C51A—C52A1.381 (5)O2S—C2S1.407 (5)
N2A—Ru1A—N1A77.78 (12)C44A—C45A—C46A119.8 (4)
N2A—Ru1A—P2A92.42 (8)C41A—C46A—C45A121.5 (3)
N1A—Ru1A—P2A89.83 (8)C52A—C51A—C56A119.0 (3)
N2A—Ru1A—P1A90.88 (8)C52A—C51A—P2A119.5 (3)
N1A—Ru1A—P1A89.23 (8)C56A—C51A—P2A121.4 (3)
P2A—Ru1A—P1A176.30 (3)C51A—C52A—C53A120.2 (4)
N2A—Ru1A—Cl2A91.74 (8)C54A—C53A—C52A119.9 (4)
N1A—Ru1A—Cl2A169.51 (9)C55A—C54A—C53A120.1 (4)
P2A—Ru1A—Cl2A90.90 (3)C54A—C55A—C56A120.6 (4)
P1A—Ru1A—Cl2A90.67 (3)C55A—C56A—C51A120.2 (4)
N2A—Ru1A—Cl1A170.83 (8)C62A—C61A—C66A118.2 (4)
N1A—Ru1A—Cl1A93.16 (9)C62A—C61A—P2A116.2 (3)
P2A—Ru1A—Cl1A88.95 (3)C66A—C61A—P2A125.2 (3)
P1A—Ru1A—Cl1A87.54 (3)C63A—C62A—C61A121.1 (4)
Cl2A—Ru1A—Cl1A97.31 (3)C64A—C63A—C62A120.6 (5)
C21A—P1A—C31A103.20 (16)C65A—C64A—C63A119.2 (4)
C21A—P1A—C11A105.93 (17)C64A—C65A—C66A121.6 (5)
C31A—P1A—C11A100.90 (15)C61A—C66A—C65A119.2 (4)
C21A—P1A—Ru1A109.31 (11)N1B—Ru1B—N1Bi78.19 (16)
C31A—P1A—Ru1A122.25 (12)N1B—Ru1B—P1Bi92.76 (8)
C11A—P1A—Ru1A113.70 (12)N1Bi—Ru1B—P1Bi91.09 (8)
C41A—P2A—C61A106.71 (16)N1B—Ru1B—P1B91.09 (8)
C41A—P2A—C51A102.31 (15)N1Bi—Ru1B—P1B92.76 (8)
C61A—P2A—C51A102.00 (16)P1Bi—Ru1B—P1B175.04 (4)
C41A—P2A—Ru1A113.46 (11)N1B—Ru1B—Cl1B92.01 (8)
C61A—P2A—Ru1A109.56 (12)N1Bi—Ru1B—Cl1B170.15 (8)
C51A—P2A—Ru1A121.39 (12)P1Bi—Ru1B—Cl1B88.39 (3)
C1A—N1A—Ru1A117.6 (2)P1B—Ru1B—Cl1B88.35 (3)
C2A—N2A—Ru1A118.3 (2)N1B—Ru1B—Cl1Bi170.15 (8)
N1A—C1A—C6A126.7 (4)N1Bi—Ru1B—Cl1Bi92.01 (8)
N1A—C1A—C2A113.4 (3)P1Bi—Ru1B—Cl1Bi88.35 (3)
C6A—C1A—C2A119.9 (3)P1B—Ru1B—Cl1Bi88.39 (3)
N2A—C2A—C3A127.8 (4)Cl1B—Ru1B—Cl1Bi97.81 (4)
N2A—C2A—C1A112.8 (3)C1B—N1B—Ru1B117.2 (2)
C3A—C2A—C1A119.4 (3)C21B—P1B—C11B105.47 (17)
C4A—C3A—C2A118.7 (4)C21B—P1B—C31B103.63 (15)
C3A—C4A—C5A122.0 (4)C11B—P1B—C31B100.28 (16)
C6A—C5A—C4A121.8 (4)C21B—P1B—Ru1B112.07 (12)
C5A—C6A—C1A118.2 (4)C11B—P1B—Ru1B114.46 (11)
C12A—C11A—C16A118.3 (4)C31B—P1B—Ru1B119.29 (11)
C12A—C11A—P1A117.6 (3)N1B—C1B—C6B126.8 (3)
C16A—C11A—P1A124.1 (3)N1B—C1B—C1Bi113.65 (19)
C13A—C12A—C11A120.8 (4)C6B—C1B—C1Bi119.5 (2)
C14A—C13A—C12A120.5 (5)C6B—C5B—C5Bi121.6 (2)
C13A—C14A—C15A120.4 (4)C5B—C6B—C1B118.9 (3)
C14A—C15A—C16A119.6 (4)C12B—C11B—C16B118.6 (4)
C15A—C16A—C11A120.2 (4)C12B—C11B—P1B116.9 (3)
C26A—C21A—C22A117.8 (3)C16B—C11B—P1B124.0 (3)
C26A—C21A—P1A120.5 (3)C13B—C12B—C11B120.6 (4)
C22A—C21A—P1A121.0 (3)C12B—C13B—C14B120.5 (4)
C23A—C22A—C21A120.5 (4)C15B—C14B—C13B120.0 (4)
C24A—C23A—C22A120.8 (4)C14B—C15B—C16B120.6 (4)
C23A—C24A—C25A119.6 (4)C15B—C16B—C11B119.7 (4)
C24A—C25A—C26A119.8 (4)C26B—C21B—C22B118.3 (3)
C21A—C26A—C25A121.5 (3)C26B—C21B—P1B121.7 (3)
C36A—C31A—C32A119.2 (3)C22B—C21B—P1B119.6 (3)
C36A—C31A—P1A121.6 (3)C23B—C22B—C21B120.2 (4)
C32A—C31A—P1A119.1 (3)C24B—C23B—C22B119.8 (4)
C31A—C32A—C33A120.3 (4)C25B—C24B—C23B120.5 (4)
C32A—C33A—C34A120.3 (4)C24B—C25B—C26B120.4 (4)
C35A—C34A—C33A119.9 (4)C21B—C26B—C25B120.8 (4)
C34A—C35A—C36A119.7 (4)C36B—C31B—C32B119.6 (3)
C31A—C36A—C35A120.5 (4)C36B—C31B—P1B120.2 (3)
C46A—C41A—C42A118.0 (3)C32B—C31B—P1B120.2 (3)
C46A—C41A—P2A120.3 (3)C33B—C32B—C31B119.8 (4)
C42A—C41A—P2A121.5 (3)C32B—C33B—C34B120.1 (4)
C43A—C42A—C41A120.5 (4)C35B—C34B—C33B120.0 (4)
C42A—C43A—C44A120.9 (4)C34B—C35B—C36B120.5 (4)
C45A—C44A—C43A119.2 (4)C31B—C36B—C35B120.1 (4)
Symmetry code: (i) x+2, y, z+1/2.
 

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