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The title compound, [Na4(C12H27O3SSi)4(CH4O)6], may be regarded as an assembly of short-contact ion triplets built of a dinuclear [Na2(MeOH)6]2+ cation and two [Na{SSi(OtBu)3}2] anions, related by a centre of symmetry. The presence of sulfur and oxygen bridges, as well as O—H...O and O—H...S hydrogen bonds, results in a tetra­nuclear complex with all Na atoms penta­coordinated. The complex sits on a centre of symmetry.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806035070/bx2025sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536806035070/bx2025Isup2.hkl
Contains datablock I

CCDC reference: 624017

Key indicators

  • Single-crystal X-ray study
  • T = 150 K
  • Mean [sigma](C-C)= 0.004 Å
  • R factor = 0.037
  • wR factor = 0.145
  • Data-to-parameter ratio = 18.7

checkCIF/PLATON results

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No errors found in this datablock

Computing details top

Data collection: KM-4 Software (Gałdecki et al., 1996); cell refinement: KM-4 Software; data reduction: KM-4 Software; 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) and Mercury (Macrae et al., 2006); software used to prepare material for publication: WinGX (Farrugia, 1999).

Tetrakis(µ3-methanol)bis(methanol-κO)(µ2-tri-tert- butoxysilanethiolato-κ3S;S,O)bis(tri-tert-butoxysilanethiolato- κ2S,O)tetrasodium(I) top
Crystal data top
[Na4(C12H27O3SSi)4(CH4O)6]Z = 1
Mr = 1402.16F(000) = 764
Triclinic, P1Dx = 1.126 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 8.298 (2) ÅCell parameters from 46 reflections
b = 14.988 (3) Åθ = 3.5–31°
c = 17.932 (4) ŵ = 0.25 mm1
α = 101.90 (3)°T = 150 K
β = 99.64 (3)°Plate, colourless
γ = 103.38 (3)°0.5 × 0.4 × 0.2 mm
V = 2068.1 (9) Å3
Data collection top
Kuma KM-4
diffractometer
θmax = 25.6°, θmin = 1.2°
Graphite monochromatorh = 109
ω/2θ scansk = 1717
7983 measured reflectionsl = 021
7721 independent reflections3 standard reflections every 200 reflections
5883 reflections with I > 2σ(I) intensity decay: 0.7%
Rint = 0.033
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)] = 0.037Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.145H atoms treated by a mixture of independent and constrained refinement
S = 1.06 w = 1/[σ2(Fo2) + (0.0991P)2 + 0.367P]
where P = (Fo2 + 2Fc2)/3
7721 reflections(Δ/σ)max = 0.005
412 parametersΔρmax = 0.47 e Å3
0 restraintsΔρmin = 0.39 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
Si10.53647 (8)1.21023 (4)0.29777 (3)0.02378 (16)
Si20.27722 (7)0.76588 (4)0.19087 (3)0.02224 (15)
S10.35219 (7)1.14608 (4)0.34831 (3)0.03003 (16)
S20.50537 (7)0.83923 (4)0.26587 (3)0.02718 (15)
Na10.36575 (13)0.98569 (6)0.24666 (6)0.0367 (2)
Na20.43581 (12)0.89568 (7)0.41645 (5)0.0310 (2)
O10.7265 (2)1.25378 (11)0.35334 (9)0.0301 (4)
O20.5510 (2)1.12270 (11)0.22889 (9)0.0270 (3)
O30.4998 (2)1.29671 (11)0.26201 (10)0.0298 (4)
O40.21070 (19)0.84477 (10)0.15069 (9)0.0251 (3)
O50.12151 (19)0.72712 (10)0.23256 (9)0.0258 (3)
O60.2748 (2)0.67304 (11)0.12471 (9)0.0271 (3)
C10.0371 (4)0.9325 (2)0.36431 (17)0.0443 (7)
H1A0.01810.89510.39650.066*
H1B0.04560.92680.31640.066*
H1C0.08040.99920.39370.066*
C20.2417 (3)0.9401 (2)0.57091 (17)0.0432 (6)
H2A0.2630.96520.62770.065*
H2B0.16830.87490.55580.065*
H2C0.18560.97960.54450.065*
C30.6683 (4)0.7390 (2)0.43424 (18)0.0545 (8)
H3A0.65240.73350.37790.082*
H3B0.6220.67670.4430.082*
H3C0.78990.76240.4590.082*
C100.8116 (3)1.34418 (17)0.40831 (14)0.0339 (6)
C110.8734 (4)1.41576 (19)0.36342 (18)0.0481 (7)
H11A0.94691.39250.33120.072*
H11B0.93761.47650.40040.072*
H11C0.77551.42450.32970.072*
C120.6944 (4)1.3758 (2)0.45734 (18)0.0548 (8)
H12A0.59851.38660.42370.082*
H12B0.75681.43490.49690.082*
H12C0.65171.32660.48330.082*
C130.9633 (4)1.3279 (2)0.45815 (19)0.0586 (9)
H13A0.92361.28590.49060.088*
H13B1.03651.38870.49190.088*
H13C1.02781.29840.42420.088*
C200.6783 (3)1.11954 (17)0.18231 (14)0.0327 (5)
C210.7371 (4)1.21283 (19)0.16109 (16)0.0398 (6)
H21A0.63931.22710.13210.06*
H21B0.821.20790.12850.06*
H21C0.79011.26370.2090.06*
C220.8263 (4)1.0954 (2)0.22854 (17)0.0439 (7)
H22A0.87751.14530.27720.066*
H22B0.91181.09090.19730.066*
H22C0.78521.03460.24080.066*
C230.5903 (4)1.0400 (2)0.10903 (17)0.0533 (8)
H23A0.55310.98030.12370.08*
H23B0.66981.03370.07480.08*
H23C0.49141.05460.08130.08*
C300.3505 (3)1.31012 (19)0.21777 (16)0.0370 (6)
C310.2484 (4)1.2192 (2)0.15716 (17)0.0473 (7)
H31A0.32061.19770.12340.071*
H31B0.15111.2310.12540.071*
H31C0.20741.17030.18360.071*
C320.4155 (4)1.3880 (2)0.1783 (2)0.0584 (9)
H32A0.4811.4460.21840.088*
H32B0.31871.40050.14680.088*
H32C0.48831.36740.14450.088*
C330.2441 (4)1.3424 (2)0.2732 (2)0.0534 (8)
H33A0.20821.29320.30020.08*
H33B0.14361.35360.24360.08*
H33C0.31181.40120.31180.08*
C400.0507 (3)0.83822 (17)0.09963 (14)0.0303 (5)
C410.0670 (3)0.8666 (2)0.15019 (17)0.0450 (7)
H41A0.0990.81860.17880.067*
H41B0.16950.87170.1170.067*
H41C0.00890.92810.18750.067*
C420.0298 (3)0.73908 (18)0.04606 (15)0.0374 (6)
H42A0.04690.72280.01270.056*
H42B0.13810.73720.01320.056*
H42C0.04980.69330.07770.056*
C430.0948 (4)0.9098 (2)0.05193 (17)0.0491 (7)
H43A0.14660.97320.08730.074*
H43B0.0090.90990.01660.074*
H43C0.17510.89240.02120.074*
C500.0705 (3)0.64053 (16)0.25804 (14)0.0304 (5)
C510.0495 (4)0.6605 (2)0.31068 (18)0.0486 (7)
H51A0.01390.71020.3580.073*
H51B0.10010.60260.32520.073*
H51C0.13970.68160.28280.073*
C520.0238 (4)0.55871 (18)0.18731 (16)0.0432 (7)
H52A0.11980.57470.15850.065*
H52B0.06610.50160.20470.065*
H52C0.05360.5470.15310.065*
C530.2242 (4)0.6198 (2)0.30164 (17)0.0440 (7)
H53A0.30050.60930.26660.066*
H53B0.18760.5630.32020.066*
H53C0.28430.67390.34650.066*
C600.3905 (3)0.65625 (17)0.07526 (14)0.0325 (5)
C610.5391 (3)0.63416 (19)0.12255 (17)0.0409 (6)
H61A0.59890.68880.16690.061*
H61B0.61740.62070.08930.061*
H61C0.49680.57880.1420.061*
C620.4518 (4)0.7420 (2)0.04459 (16)0.0411 (6)
H62A0.35470.75350.01240.062*
H62B0.53360.73030.01280.062*
H62C0.50660.79770.08870.062*
C630.2891 (4)0.5709 (2)0.00865 (18)0.0552 (8)
H63A0.24590.51720.030.083*
H63B0.36260.55390.02620.083*
H63C0.19340.58640.02080.083*
O100.3990 (2)0.94111 (13)0.54874 (10)0.0346 (4)
O110.1739 (2)0.89821 (14)0.34444 (12)0.0436 (5)
O120.5828 (3)0.80317 (16)0.46715 (12)0.0486 (5)
H10D0.451 (5)0.917 (3)0.574 (2)0.072 (12)*
H11D0.137 (4)0.847 (2)0.3104 (19)0.049 (9)*
H12D0.595 (4)0.813 (3)0.514 (2)0.064 (11)*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Si10.0292 (3)0.0205 (3)0.0205 (3)0.0040 (2)0.0038 (2)0.0075 (2)
Si20.0258 (3)0.0205 (3)0.0201 (3)0.0051 (2)0.0045 (2)0.0067 (2)
S10.0337 (3)0.0299 (3)0.0274 (3)0.0043 (2)0.0089 (2)0.0128 (2)
S20.0282 (3)0.0282 (3)0.0221 (3)0.0057 (2)0.0022 (2)0.0050 (2)
Na10.0438 (6)0.0219 (5)0.0378 (6)0.0040 (4)0.0009 (4)0.0068 (4)
Na20.0361 (5)0.0336 (5)0.0238 (5)0.0099 (4)0.0058 (4)0.0085 (4)
O10.0316 (9)0.0231 (8)0.0277 (8)0.0018 (7)0.0017 (7)0.0028 (7)
O20.0304 (8)0.0247 (8)0.0248 (8)0.0051 (6)0.0066 (7)0.0063 (6)
O30.0323 (8)0.0247 (8)0.0332 (9)0.0058 (7)0.0046 (7)0.0139 (7)
O40.0259 (8)0.0243 (8)0.0241 (8)0.0035 (6)0.0029 (6)0.0103 (6)
O50.0299 (8)0.0222 (8)0.0285 (8)0.0074 (6)0.0089 (7)0.0114 (6)
O60.0304 (8)0.0236 (8)0.0256 (8)0.0065 (6)0.0067 (7)0.0033 (6)
C10.0443 (15)0.0555 (17)0.0414 (15)0.0250 (13)0.0148 (13)0.0137 (13)
C20.0405 (15)0.0498 (16)0.0410 (15)0.0091 (12)0.0124 (12)0.0165 (13)
C30.064 (2)0.073 (2)0.0453 (17)0.0438 (18)0.0204 (15)0.0226 (16)
C100.0367 (13)0.0267 (12)0.0273 (12)0.0027 (10)0.0015 (10)0.0027 (10)
C110.0547 (17)0.0291 (13)0.0468 (16)0.0081 (12)0.0069 (14)0.0063 (12)
C120.0584 (19)0.0447 (17)0.0458 (17)0.0016 (14)0.0167 (15)0.0085 (13)
C130.0576 (19)0.0474 (17)0.0473 (17)0.0011 (14)0.0205 (15)0.0025 (14)
C200.0390 (13)0.0307 (12)0.0274 (12)0.0060 (10)0.0135 (10)0.0046 (10)
C210.0464 (15)0.0443 (15)0.0345 (14)0.0115 (12)0.0173 (12)0.0176 (12)
C220.0441 (15)0.0490 (16)0.0496 (17)0.0216 (13)0.0189 (13)0.0200 (13)
C230.0588 (19)0.0525 (18)0.0364 (15)0.0000 (15)0.0195 (14)0.0053 (13)
C300.0380 (13)0.0406 (14)0.0412 (14)0.0167 (11)0.0080 (11)0.0238 (12)
C310.0402 (15)0.0595 (18)0.0399 (15)0.0109 (13)0.0024 (12)0.0199 (14)
C320.065 (2)0.0586 (19)0.069 (2)0.0222 (16)0.0151 (17)0.0465 (18)
C330.0578 (19)0.0569 (19)0.062 (2)0.0327 (16)0.0196 (16)0.0271 (16)
C400.0292 (12)0.0315 (12)0.0292 (12)0.0078 (10)0.0012 (10)0.0126 (10)
C410.0356 (14)0.0508 (17)0.0481 (16)0.0190 (12)0.0027 (12)0.0094 (13)
C420.0350 (13)0.0381 (14)0.0337 (13)0.0070 (11)0.0028 (11)0.0097 (11)
C430.0524 (17)0.0465 (16)0.0450 (16)0.0047 (13)0.0060 (13)0.0285 (14)
C500.0356 (12)0.0248 (11)0.0327 (13)0.0041 (10)0.0082 (10)0.0157 (10)
C510.0591 (18)0.0469 (16)0.0526 (18)0.0136 (14)0.0296 (15)0.0280 (14)
C520.0487 (16)0.0309 (13)0.0412 (15)0.0042 (12)0.0052 (12)0.0108 (12)
C530.0460 (15)0.0385 (15)0.0487 (16)0.0083 (12)0.0014 (13)0.0248 (13)
C600.0363 (13)0.0329 (13)0.0280 (12)0.0105 (10)0.0101 (10)0.0036 (10)
C610.0405 (15)0.0383 (14)0.0494 (16)0.0183 (12)0.0132 (12)0.0127 (12)
C620.0445 (15)0.0510 (16)0.0367 (14)0.0175 (13)0.0173 (12)0.0192 (12)
C630.0538 (18)0.0517 (18)0.0447 (17)0.0078 (14)0.0130 (14)0.0152 (14)
O100.0445 (10)0.0366 (10)0.0299 (9)0.0174 (8)0.0119 (8)0.0147 (8)
O110.0351 (10)0.0404 (11)0.0487 (12)0.0146 (8)0.0044 (9)0.0040 (9)
O120.0692 (14)0.0642 (14)0.0285 (10)0.0428 (11)0.0140 (10)0.0175 (9)
Geometric parameters (Å, º) top
Si1—O11.6234 (18)C21—H21C0.98
Si1—O31.6261 (17)C22—H22A0.98
Si1—O21.6480 (17)C22—H22B0.98
Si1—S12.0559 (10)C22—H22C0.98
Si1—Na13.2029 (15)C23—H23A0.98
Si2—O61.6254 (17)C23—H23B0.98
Si2—O51.6496 (16)C23—H23C0.98
Si2—O41.6559 (16)C30—C331.515 (4)
Si2—S22.0434 (13)C30—C311.517 (4)
Si2—Na13.1095 (14)C30—C321.526 (4)
S1—Na12.7386 (15)C31—H31A0.98
S2—Na12.7632 (13)C31—H31B0.98
S2—Na22.8542 (13)C31—H31C0.98
Na1—O42.362 (2)C32—H32A0.98
Na1—O22.3778 (19)C32—H32B0.98
Na1—O112.871 (2)C32—H32C0.98
Na1—Na23.5906 (16)C33—H33A0.98
Na2—O122.273 (2)C33—H33B0.98
Na2—O112.347 (2)C33—H33C0.98
Na2—O10i2.405 (2)C40—C411.513 (4)
Na2—O102.420 (2)C40—C421.521 (3)
Na2—C2i3.129 (3)C40—C431.522 (3)
Na2—Na2i3.663 (2)C41—H41A0.98
O1—C101.442 (3)C41—H41B0.98
O2—C201.455 (3)C41—H41C0.98
O3—C301.434 (3)C42—H42A0.98
O4—C401.451 (3)C42—H42B0.98
O5—C501.459 (3)C42—H42C0.98
O6—C601.441 (3)C43—H43A0.98
C1—O111.418 (3)C43—H43B0.98
C1—H1A0.98C43—H43C0.98
C1—H1B0.98C50—C531.511 (4)
C1—H1C0.98C50—C521.519 (4)
C2—O101.424 (3)C50—C511.519 (4)
C2—H2A0.98C51—H51A0.98
C2—H2B0.98C51—H51B0.98
C2—H2C0.98C51—H51C0.98
C3—O121.414 (3)C52—H52A0.98
C3—H3A0.98C52—H52B0.98
C3—H3B0.98C52—H52C0.98
C3—H3C0.98C53—H53A0.98
C10—C121.507 (4)C53—H53B0.98
C10—C131.516 (4)C53—H53C0.98
C10—C111.517 (4)C60—C621.515 (4)
C11—H11A0.98C60—C611.518 (4)
C11—H11B0.98C60—C631.519 (4)
C11—H11C0.98C61—H61A0.98
C12—H12A0.98C61—H61B0.98
C12—H12B0.98C61—H61C0.98
C12—H12C0.98C62—H62A0.98
C13—H13A0.98C62—H62B0.98
C13—H13B0.98C62—H62C0.98
C13—H13C0.98C63—H63A0.98
C20—C211.518 (3)C63—H63B0.98
C20—C231.520 (4)C63—H63C0.98
C20—C221.522 (4)O10—H10D0.78 (4)
C21—H21A0.98O11—H11D0.83 (3)
C21—H21B0.98O12—H12D0.81 (4)
O1—Si1—O3104.47 (9)C21—C20—C23110.5 (2)
O1—Si1—O2105.05 (9)O2—C20—C22108.29 (19)
O3—Si1—O2111.15 (9)C21—C20—C22111.2 (2)
O1—Si1—S1116.00 (7)C23—C20—C22110.2 (2)
O3—Si1—S1115.87 (7)C20—C21—H21A109.5
O2—Si1—S1103.90 (7)C20—C21—H21B109.5
O1—Si1—Na1120.12 (7)H21A—C21—H21B109.5
O3—Si1—Na1133.03 (7)C20—C21—H21C109.5
O2—Si1—Na146.10 (6)H21A—C21—H21C109.5
S1—Si1—Na157.97 (4)H21B—C21—H21C109.5
O6—Si2—O5104.09 (9)C20—C22—H22A109.5
O6—Si2—O4111.37 (8)C20—C22—H22B109.5
O5—Si2—O4102.44 (8)H22A—C22—H22B109.5
O6—Si2—S2117.11 (7)C20—C22—H22C109.5
O5—Si2—S2115.49 (7)H22A—C22—H22C109.5
O4—Si2—S2105.49 (7)H22B—C22—H22C109.5
O6—Si2—Na1148.12 (7)C20—C23—H23A109.5
O5—Si2—Na1104.62 (7)C20—C23—H23B109.5
O4—Si2—Na148.45 (6)H23A—C23—H23B109.5
S2—Si2—Na160.75 (4)C20—C23—H23C109.5
Si1—S1—Na182.51 (4)H23A—C23—H23C109.5
Si2—S2—Na179.07 (4)H23B—C23—H23C109.5
Si2—S2—Na2106.66 (4)O3—C30—C33109.0 (2)
Na1—S2—Na279.44 (4)O3—C30—C31110.8 (2)
O4—Na1—O2127.76 (7)C33—C30—C31110.5 (2)
O4—Na1—S1146.61 (6)O3—C30—C32105.4 (2)
O2—Na1—S169.40 (5)C33—C30—C32110.3 (2)
O4—Na1—S269.88 (5)C31—C30—C32110.7 (2)
O2—Na1—S2116.42 (6)C30—C31—H31A109.5
S1—Na1—S2133.13 (4)C30—C31—H31B109.5
O4—Na1—O1182.81 (7)H31A—C31—H31B109.5
O2—Na1—O11148.80 (7)C30—C31—H31C109.5
S1—Na1—O1181.10 (5)H31A—C31—H31C109.5
S2—Na1—O1176.74 (5)H31B—C31—H31C109.5
O4—Na1—Si231.64 (4)C30—C32—H32A109.5
O2—Na1—Si2139.58 (6)C30—C32—H32B109.5
S1—Na1—Si2150.31 (4)H32A—C32—H32B109.5
S2—Na1—Si240.18 (3)C30—C32—H32C109.5
O11—Na1—Si269.21 (5)H32A—C32—H32C109.5
O4—Na1—Si1150.96 (6)H32B—C32—H32C109.5
O2—Na1—Si129.96 (4)C30—C33—H33A109.5
S1—Na1—Si139.52 (3)C30—C33—H33B109.5
S2—Na1—Si1130.07 (4)H33A—C33—H33B109.5
O11—Na1—Si1119.52 (6)C30—C33—H33C109.5
Si2—Na1—Si1167.56 (4)H33A—C33—H33C109.5
O4—Na1—Na2100.77 (5)H33B—C33—H33C109.5
O2—Na1—Na2124.00 (6)O4—C40—C41108.17 (19)
S1—Na1—Na285.56 (4)O4—C40—C42111.91 (19)
S2—Na1—Na251.39 (3)C41—C40—C42110.8 (2)
O11—Na1—Na240.72 (5)O4—C40—C43105.25 (19)
Si2—Na1—Na272.02 (4)C41—C40—C43110.1 (2)
Si1—Na1—Na2108.27 (4)C42—C40—C43110.5 (2)
O12—Na2—O11144.91 (9)C40—C41—H41A109.5
O12—Na2—O10i111.68 (9)C40—C41—H41B109.5
O11—Na2—O10i103.36 (8)H41A—C41—H41B109.5
O12—Na2—O1083.08 (8)C40—C41—H41C109.5
O11—Na2—O10100.85 (8)H41A—C41—H41C109.5
O10i—Na2—O1081.23 (8)H41B—C41—H41C109.5
O12—Na2—S292.68 (6)C40—C42—H42A109.5
O11—Na2—S283.93 (6)C40—C42—H42B109.5
O10i—Na2—S298.31 (6)H42A—C42—H42B109.5
O10—Na2—S2175.19 (6)C40—C42—H42C109.5
O12—Na2—C2i95.08 (9)H42A—C42—H42C109.5
O11—Na2—C2i118.33 (9)H42B—C42—H42C109.5
O10i—Na2—C2i25.84 (7)C40—C43—H43A109.5
O10—Na2—C2i98.65 (8)C40—C43—H43B109.5
S2—Na2—C2i79.39 (7)H43A—C43—H43B109.5
O12—Na2—Na1140.83 (7)C40—C43—H43C109.5
O11—Na2—Na152.94 (6)H43A—C43—H43C109.5
O10i—Na2—Na172.30 (6)H43B—C43—H43C109.5
O10—Na2—Na1134.56 (6)O5—C50—C53110.39 (19)
S2—Na2—Na149.16 (3)O5—C50—C52109.36 (18)
C2i—Na2—Na172.17 (7)C53—C50—C52110.8 (2)
O12—Na2—Na2i99.38 (7)O5—C50—C51104.70 (19)
O11—Na2—Na2i106.02 (7)C53—C50—C51111.6 (2)
O10i—Na2—Na2i40.77 (5)C52—C50—C51109.9 (2)
O10—Na2—Na2i40.46 (5)C50—C51—H51A109.5
S2—Na2—Na2i138.87 (5)C50—C51—H51B109.5
C2i—Na2—Na2i60.56 (7)H51A—C51—H51B109.5
Na1—Na2—Na2i105.30 (4)C50—C51—H51C109.5
C10—O1—Si1132.77 (16)H51A—C51—H51C109.5
C20—O2—Si1129.96 (14)H51B—C51—H51C109.5
C20—O2—Na1123.89 (13)C50—C52—H52A109.5
Si1—O2—Na1103.95 (8)C50—C52—H52B109.5
C30—O3—Si1133.23 (15)H52A—C52—H52B109.5
C40—O4—Si2131.46 (14)C50—C52—H52C109.5
C40—O4—Na1121.66 (13)H52A—C52—H52C109.5
Si2—O4—Na199.92 (8)H52B—C52—H52C109.5
C50—O5—Si2131.83 (15)C50—C53—H53A109.5
C60—O6—Si2131.83 (14)C50—C53—H53B109.5
O11—C1—H1A109.5H53A—C53—H53B109.5
O11—C1—H1B109.5C50—C53—H53C109.5
H1A—C1—H1B109.5H53A—C53—H53C109.5
O11—C1—H1C109.5H53B—C53—H53C109.5
H1A—C1—H1C109.5O6—C60—C62110.6 (2)
H1B—C1—H1C109.5O6—C60—C61108.4 (2)
O10—C2—H2A109.5C62—C60—C61110.7 (2)
O10—C2—H2B109.5O6—C60—C63105.3 (2)
H2A—C2—H2B109.5C62—C60—C63110.8 (2)
O10—C2—H2C109.5C61—C60—C63110.8 (2)
H2A—C2—H2C109.5C60—C61—H61A109.5
H2B—C2—H2C109.5C60—C61—H61B109.5
O12—C3—H3A109.5H61A—C61—H61B109.5
O12—C3—H3B109.5C60—C61—H61C109.5
H3A—C3—H3B109.5H61A—C61—H61C109.5
O12—C3—H3C109.5H61B—C61—H61C109.5
H3A—C3—H3C109.5C60—C62—H62A109.5
H3B—C3—H3C109.5C60—C62—H62B109.5
O1—C10—C12110.6 (2)H62A—C62—H62B109.5
O1—C10—C13105.1 (2)C60—C62—H62C109.5
C12—C10—C13111.3 (3)H62A—C62—H62C109.5
O1—C10—C11108.8 (2)H62B—C62—H62C109.5
C12—C10—C11111.4 (2)C60—C63—H63A109.5
C13—C10—C11109.4 (2)C60—C63—H63B109.5
C10—C11—H11A109.5H63A—C63—H63B109.5
C10—C11—H11B109.5C60—C63—H63C109.5
H11A—C11—H11B109.5H63A—C63—H63C109.5
C10—C11—H11C109.5H63B—C63—H63C109.5
H11A—C11—H11C109.5C2—O10—Na2i106.76 (16)
H11B—C11—H11C109.5C2—O10—Na2126.00 (16)
C10—C12—H12A109.5Na2i—O10—Na298.77 (8)
C10—C12—H12B109.5C2—O10—H10D110 (3)
H12A—C12—H12B109.5Na2i—O10—H10D105 (3)
C10—C12—H12C109.5Na2—O10—H10D108 (3)
H12A—C12—H12C109.5C1—O11—Na2134.03 (17)
H12B—C12—H12C109.5C1—O11—Na1118.50 (17)
C10—C13—H13A109.5Na2—O11—Na186.34 (7)
C10—C13—H13B109.5C1—O11—H11D110 (2)
H13A—C13—H13B109.5Na2—O11—H11D106 (2)
C10—C13—H13C109.5Na1—O11—H11D92 (2)
H13A—C13—H13C109.5C3—O12—Na2132.85 (18)
H13B—C13—H13C109.5C3—O12—H12D115 (3)
O2—C20—C21111.3 (2)Na2—O12—H12D112 (3)
O2—C20—C23105.2 (2)
Symmetry code: (i) x+1, y+2, z+1.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
O10—H10D···S1i0.78 (4)2.44 (4)3.216 (2)172 (4)
O11—H11D···O50.83 (3)1.99 (3)2.803 (3)163 (3)
O12—H12D···S1i0.81 (4)2.35 (4)3.161 (2)175 (4)
Symmetry code: (i) x+1, y+2, z+1.
 

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