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The title compound, tris­(diethyl­di­thio­phosphato)-1κ2S,S′;2κ2S,S′;3κ2S,S′-μ-o-phenyl­anthranilato-1:3κ2O,O′-N,N-di­meth­yl­form­amide-2κO3-thio-tri-μ-thio-1:2κ2S;1:3κ2S; 2:3κ2S-triangulo-trimolybdenum(3Mo—Mo), [Mo3S4(o-C6H4COO-NH-C6H5)(DTP)3(DMF)] or [Mo3S4(C13H10NO2)(C4H10O2PS2)3(C3H7NO)] (DTP is diethyl di­thio­phosphate and DMF is N,N-di­methyl­form­amide), was synthesized from [Mo3S4(DTP)4(H2O)] in DMF by a ligand-substitution reaction, in which N-phenyl­anthranilate replaces the bridging DTP ligand. Its structure was determined by X-ray diffraction analysis. This ligand substitution shortens its bridged Mo—Mo bond from 2.734 (1) to 2.6847 (7) Å.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536802012060/cf6191sup1.cif
Contains datablocks I, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536802012060/cf6191Isup2.hkl
Contains datablock I

CCDC reference: 193709

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.017 Å
  • R factor = 0.058
  • wR factor = 0.163
  • Data-to-parameter ratio = 17.2

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry


Yellow Alert Alert Level C:
PLAT_360 Alert C Short C(sp3)-C(sp3) Bond C(21) - C(22) = 1.38 Ang. PLAT_360 Alert C Short C(sp3)-C(sp3) Bond C(23) - C(24) = 1.38 Ang. PLAT_360 Alert C Short C(sp3)-C(sp3) Bond C(31) - C(32) = 1.34 Ang.
0 Alert Level A = Potentially serious problem
0 Alert Level B = Potential problem
3 Alert Level C = Please check

Computing details top

Data collection: SMART (Siemens, 1996); cell refinement: SMART and SAINT (Siemens, 1994); data reduction: XPREP in SHELXTL (Siemens, 1994); program(s) used to solve structure: SHELXTL; program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL.

(I) top
Crystal data top
[Mo3S4(C13H10NO2)(C4H10O2PS2)3(C3H7NO)]Z = 2
Mr = 1257.01F(000) = 1264
Triclinic, P1Dx = 1.713 Mg m3
a = 12.4661 (2) ÅMo Kα radiation, λ = 0.71073 Å
b = 14.1240 (2) ÅCell parameters from 6265 reflections
c = 14.8507 (1) Åθ = 1.5–25.1°
α = 74.787 (1)°µ = 1.33 mm1
β = 76.232 (1)°T = 293 K
γ = 80.688 (1)°Rectangular block, black
V = 2436.84 (5) Å30.34 × 0.22 × 0.13 mm
Data collection top
SMART CCD area-detector
diffractometer
8550 independent reflections
Radiation source: fine-focus sealed tube6518 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.051
φ and ω scansθmax = 25.1°, θmin = 1.5°
Absorption correction: multi-scan
(SADABS; Sheldrick, 1996)
h = 1314
Tmin = 0.630, Tmax = 0.841k = 1616
12774 measured reflectionsl = 1017
Refinement top
Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.058H-atom parameters constrained
wR(F2) = 0.163 w = 1/[σ2(Fo2) + (0.0567P)2 + 6.1749P]
where P = (Fo2 + 2Fc2)/3
S = 1.18(Δ/σ)max < 0.001
8550 reflectionsΔρmax = 0.75 e Å3
497 parametersΔρmin = 0.73 e Å3
3 restraintsExtinction correction: SHELXL97, Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4
Primary atom site location: structure-invariant direct methodsExtinction coefficient: 0.0029 (3)
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
Mo10.51150 (5)0.23261 (5)0.44006 (4)0.0527 (2)
Mo20.30777 (5)0.17815 (5)0.44520 (4)0.0538 (2)
Mo30.45995 (5)0.22608 (5)0.27646 (4)0.0528 (2)
S0.36889 (15)0.33357 (13)0.37313 (13)0.0555 (4)
S10.43144 (17)0.09706 (14)0.53776 (14)0.0598 (5)
S20.36227 (17)0.09094 (14)0.32837 (14)0.0601 (5)
S30.61448 (16)0.14449 (14)0.33299 (14)0.0586 (5)
S110.67432 (18)0.18006 (17)0.52365 (16)0.0713 (6)
S120.4691 (2)0.34310 (17)0.55576 (16)0.0743 (6)
S210.1854 (2)0.26015 (16)0.57498 (17)0.0776 (6)
S220.18039 (18)0.04351 (15)0.54110 (15)0.0690 (5)
S310.34715 (19)0.33141 (16)0.15896 (15)0.0718 (6)
S320.5537 (2)0.16950 (18)0.12217 (16)0.0754 (6)
P10.6044 (2)0.27451 (17)0.60466 (16)0.0700 (6)
P20.10727 (18)0.13972 (17)0.62008 (16)0.0694 (6)
P30.4264 (2)0.24745 (18)0.06919 (16)0.0745 (6)
O110.6854 (6)0.3467 (5)0.6091 (4)0.0879 (18)
O120.5793 (6)0.2247 (5)0.7153 (4)0.0890 (18)
O220.0190 (5)0.1711 (5)0.6160 (5)0.097 (2)
O210.0966 (5)0.0924 (5)0.7295 (4)0.0800 (16)
C210.1925 (8)0.0582 (9)0.7694 (7)0.098 (3)
H21A0.24490.01960.72970.117*
H21B0.22780.11440.76990.117*
C220.1672 (12)0.0013 (14)0.8610 (10)0.200 (9)
H22A0.23400.02010.88560.299*
H22B0.13390.05520.86060.299*
H22C0.11620.03960.90070.299*
O310.3493 (6)0.1732 (5)0.0593 (5)0.104 (2)
C310.2470 (13)0.2024 (12)0.0359 (14)0.187 (8)
H31A0.21390.25840.06320.224*
H31B0.25870.22600.03280.224*
C320.1728 (16)0.1366 (18)0.0624 (17)0.295 (16)
H32A0.10510.16710.04230.443*
H32B0.15810.11340.13060.443*
H32C0.20190.08190.03350.443*
O320.4548 (6)0.3071 (5)0.0371 (4)0.098 (2)
O410.6119 (4)0.3531 (4)0.3495 (4)0.0603 (12)
O420.5720 (4)0.3452 (4)0.2115 (3)0.0584 (12)
O610.1602 (4)0.2463 (4)0.3785 (4)0.0666 (14)
N410.7546 (7)0.3727 (6)0.0711 (5)0.089 (2)
H41A0.70340.33510.10140.107*
N610.0086 (6)0.2577 (6)0.3171 (6)0.081 (2)
C110.7304 (11)0.4194 (8)0.5259 (8)0.112 (4)
H11A0.67720.47760.51710.135*
H11B0.74470.39280.46970.135*
C120.8336 (11)0.4459 (9)0.5385 (10)0.133 (5)
H12A0.86450.49310.48270.199*
H12B0.88550.38790.54800.199*
H12C0.81850.47400.59300.199*
C130.5020 (11)0.1503 (9)0.7573 (8)0.119 (4)
H13A0.42650.18190.76160.143*
H13B0.51290.10450.71660.143*
C140.5182 (15)0.0968 (10)0.8515 (8)0.169 (7)
H14A0.46490.04960.87840.253*
H14B0.50850.14220.89150.253*
H14C0.59190.06300.84690.253*
C230.0933 (11)0.0985 (12)0.6348 (13)0.145 (6)
H23A0.13940.11730.58740.174*
H23B0.05040.03610.62800.174*
C240.1614 (13)0.0853 (14)0.7246 (13)0.178 (8)
H24A0.20810.03450.73290.267*
H24B0.20680.14580.73100.267*
H24C0.11660.06620.77210.267*
C330.5120 (10)0.3942 (8)0.0661 (8)0.108 (4)
H33A0.56780.38690.02830.129*
H33B0.45980.45100.05550.129*
C340.5650 (9)0.4094 (8)0.1671 (7)0.096 (3)
H34A0.60440.46690.18590.144*
H34B0.50930.41870.20440.144*
H34C0.61610.35280.17730.144*
C410.6247 (6)0.3771 (5)0.2598 (6)0.0558 (17)
C420.7062 (6)0.4485 (5)0.2067 (5)0.0587 (18)
C430.7705 (6)0.4433 (6)0.1150 (6)0.065 (2)
C440.8510 (6)0.5097 (6)0.0736 (6)0.071 (2)
H44A0.89490.50740.01390.085*
C450.8666 (7)0.5773 (7)0.1189 (7)0.078 (2)
H45A0.92140.61960.09030.094*
C460.8016 (8)0.5836 (6)0.2066 (7)0.078 (2)
H46A0.81040.63160.23590.093*
C470.7244 (7)0.5189 (6)0.2503 (6)0.065 (2)
H47A0.68290.52190.31070.078*
C490.8133 (7)0.3561 (6)0.0179 (6)0.068 (2)
C500.8569 (10)0.2612 (8)0.0226 (8)0.104 (3)
H50A0.85190.21130.03290.125*
C510.9075 (12)0.2397 (12)0.1084 (12)0.134 (5)
H51A0.93450.17490.11090.161*
C520.9187 (12)0.3113 (14)0.1893 (10)0.135 (6)
H52A0.95540.29680.24710.162*
C530.8761 (11)0.4043 (11)0.1851 (8)0.116 (4)
H53A0.88160.45360.24100.139*
C540.8247 (9)0.4279 (8)0.1002 (7)0.090 (3)
H54A0.79750.49290.09870.108*
C610.0901 (9)0.2120 (7)0.3581 (7)0.088 (3)
H61A0.09440.14350.37350.106*
C620.0752 (11)0.2127 (10)0.2958 (10)0.141 (5)
H62A0.06210.14230.31630.212*
H62B0.07220.23090.22840.212*
H62C0.14710.23510.32860.212*
C630.0001 (14)0.3620 (11)0.2880 (16)0.216 (10)
H63A0.05830.38570.30550.324*
H63B0.07070.38890.31870.324*
H63C0.00680.38200.22010.324*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Mo10.0526 (4)0.0527 (4)0.0558 (4)0.0030 (3)0.0143 (3)0.0202 (3)
Mo20.0520 (4)0.0505 (4)0.0585 (4)0.0014 (3)0.0121 (3)0.0158 (3)
Mo30.0526 (4)0.0533 (4)0.0552 (4)0.0001 (3)0.0135 (3)0.0187 (3)
S0.0546 (11)0.0502 (10)0.0612 (11)0.0020 (8)0.0122 (8)0.0166 (8)
S10.0644 (12)0.0563 (11)0.0591 (11)0.0003 (9)0.0170 (9)0.0143 (9)
S20.0627 (12)0.0551 (10)0.0675 (12)0.0045 (9)0.0141 (9)0.0233 (9)
S30.0532 (11)0.0605 (11)0.0646 (11)0.0057 (8)0.0132 (9)0.0248 (9)
S110.0664 (13)0.0802 (14)0.0757 (13)0.0094 (10)0.0292 (11)0.0298 (11)
S120.0805 (15)0.0743 (13)0.0780 (14)0.0099 (11)0.0227 (11)0.0402 (11)
S210.0796 (15)0.0650 (13)0.0818 (14)0.0001 (11)0.0038 (11)0.0289 (11)
S220.0701 (13)0.0593 (12)0.0737 (13)0.0065 (10)0.0104 (10)0.0133 (10)
S310.0773 (14)0.0700 (13)0.0709 (13)0.0029 (11)0.0294 (11)0.0148 (10)
S320.0767 (14)0.0863 (15)0.0696 (13)0.0009 (11)0.0129 (11)0.0367 (12)
P10.0787 (15)0.0750 (14)0.0648 (13)0.0051 (11)0.0233 (11)0.0254 (11)
P20.0591 (13)0.0713 (14)0.0697 (13)0.0013 (10)0.0062 (10)0.0137 (11)
P30.0897 (17)0.0771 (15)0.0647 (13)0.0142 (12)0.0230 (12)0.0206 (11)
O110.110 (5)0.092 (4)0.078 (4)0.025 (4)0.037 (4)0.022 (3)
O120.115 (5)0.097 (5)0.064 (4)0.023 (4)0.026 (3)0.021 (3)
O220.066 (4)0.101 (5)0.119 (5)0.012 (4)0.027 (4)0.022 (4)
O210.063 (4)0.096 (4)0.070 (4)0.001 (3)0.009 (3)0.010 (3)
C210.082 (7)0.125 (9)0.080 (7)0.015 (6)0.023 (5)0.024 (6)
C220.124 (12)0.26 (2)0.144 (13)0.031 (13)0.039 (10)0.058 (13)
O310.108 (6)0.110 (5)0.119 (6)0.011 (4)0.049 (5)0.048 (4)
C310.161 (16)0.199 (18)0.26 (2)0.043 (14)0.102 (16)0.083 (16)
C320.21 (2)0.35 (3)0.34 (3)0.16 (2)0.16 (2)0.09 (3)
O320.137 (6)0.098 (5)0.069 (4)0.032 (4)0.028 (4)0.021 (3)
O410.064 (3)0.063 (3)0.057 (3)0.007 (2)0.015 (2)0.018 (2)
O420.054 (3)0.065 (3)0.060 (3)0.010 (2)0.014 (2)0.018 (2)
O610.051 (3)0.068 (3)0.079 (4)0.004 (3)0.021 (3)0.009 (3)
N410.094 (6)0.102 (6)0.083 (5)0.043 (5)0.012 (4)0.046 (4)
N610.060 (4)0.086 (5)0.094 (5)0.009 (4)0.026 (4)0.004 (4)
C110.151 (11)0.094 (8)0.104 (8)0.037 (8)0.054 (8)0.004 (6)
C120.141 (12)0.115 (10)0.152 (12)0.051 (9)0.047 (9)0.012 (9)
C130.144 (11)0.122 (10)0.099 (8)0.046 (9)0.024 (8)0.018 (7)
C140.28 (2)0.133 (12)0.079 (8)0.062 (13)0.010 (10)0.018 (8)
C230.081 (9)0.174 (15)0.205 (17)0.017 (9)0.067 (10)0.072 (13)
C240.114 (12)0.209 (18)0.201 (18)0.071 (12)0.045 (12)0.014 (15)
C330.130 (10)0.102 (8)0.104 (8)0.044 (7)0.018 (7)0.031 (7)
C340.119 (9)0.094 (7)0.077 (6)0.022 (6)0.024 (6)0.011 (5)
C410.051 (4)0.049 (4)0.069 (5)0.004 (3)0.014 (4)0.020 (4)
C420.048 (4)0.060 (4)0.070 (5)0.000 (3)0.011 (4)0.023 (4)
C430.054 (5)0.069 (5)0.070 (5)0.005 (4)0.007 (4)0.018 (4)
C440.052 (5)0.084 (6)0.075 (5)0.015 (4)0.004 (4)0.021 (5)
C450.065 (5)0.079 (6)0.093 (7)0.021 (4)0.019 (5)0.015 (5)
C460.084 (6)0.070 (5)0.090 (6)0.020 (5)0.022 (5)0.026 (5)
C470.068 (5)0.062 (5)0.067 (5)0.005 (4)0.014 (4)0.018 (4)
C490.055 (5)0.077 (5)0.077 (5)0.006 (4)0.008 (4)0.032 (5)
C500.119 (9)0.094 (8)0.100 (8)0.009 (7)0.014 (7)0.035 (6)
C510.125 (11)0.130 (11)0.157 (13)0.006 (9)0.004 (10)0.084 (11)
C520.117 (10)0.193 (16)0.106 (10)0.041 (11)0.031 (8)0.087 (11)
C530.140 (11)0.147 (12)0.069 (7)0.043 (9)0.018 (7)0.027 (7)
C540.094 (7)0.092 (7)0.090 (7)0.002 (6)0.031 (6)0.024 (6)
C610.091 (7)0.076 (6)0.100 (7)0.000 (5)0.043 (6)0.007 (5)
C620.130 (11)0.127 (10)0.176 (13)0.040 (9)0.083 (10)0.011 (9)
C630.169 (16)0.120 (12)0.41 (3)0.021 (11)0.190 (19)0.053 (16)
Geometric parameters (Å, º) top
Mo1—O412.227 (5)O11—C111.444 (12)
Mo1—S12.289 (2)O12—C131.456 (12)
Mo1—S32.2969 (19)O22—C231.422 (16)
Mo1—S2.3364 (19)O21—C211.419 (10)
Mo1—S122.525 (2)C21—C221.379 (13)
Mo1—S112.538 (2)O31—C311.372 (13)
Mo1—Mo32.6841 (9)C31—C321.338 (16)
Mo1—Mo22.7490 (9)O32—C331.437 (11)
Mo2—O612.255 (5)O41—C411.263 (8)
Mo2—S12.278 (2)O42—C411.279 (8)
Mo2—S22.2976 (19)O61—C611.197 (10)
Mo2—S2.3377 (19)N41—C431.388 (10)
Mo2—S212.566 (2)N41—C491.408 (10)
Mo2—S222.578 (2)N61—C611.301 (11)
Mo2—Mo32.7567 (9)N61—C631.416 (15)
Mo3—O422.232 (5)N61—C621.439 (13)
Mo3—S22.292 (2)C11—C121.461 (15)
Mo3—S32.299 (2)C13—C141.449 (16)
Mo3—S2.3377 (18)C23—C241.384 (19)
Mo3—S312.523 (2)C33—C341.462 (13)
Mo3—S322.577 (2)C41—C421.484 (10)
S11—P11.988 (3)C42—C471.394 (10)
S12—P11.998 (3)C42—C431.420 (10)
S21—P21.980 (3)C43—C441.405 (11)
S22—P21.995 (3)C44—C451.365 (11)
S31—P31.996 (3)C45—C461.376 (12)
S32—P31.981 (3)C46—C471.363 (11)
P1—O111.571 (6)C49—C541.362 (12)
P1—O121.585 (6)C49—C501.376 (13)
P2—O211.569 (6)C50—C511.368 (16)
P2—O221.575 (7)C51—C521.346 (19)
P3—O321.568 (7)C52—C531.345 (18)
P3—O311.587 (7)C53—C541.371 (15)
O41—Mo1—S1171.94 (14)S2—Mo3—Mo253.18 (5)
O41—Mo1—S383.57 (14)S3—Mo3—Mo296.93 (5)
S1—Mo1—S392.79 (7)S—Mo3—Mo253.87 (5)
O41—Mo1—S82.68 (14)S31—Mo3—Mo2104.81 (6)
S1—Mo1—S105.32 (7)S32—Mo3—Mo2143.21 (6)
S3—Mo1—S108.73 (7)Mo1—Mo3—Mo260.68 (2)
O41—Mo1—S1282.30 (14)Mo1—S—Mo370.09 (5)
S1—Mo1—S1299.12 (8)Mo1—S—Mo272.05 (6)
S3—Mo1—S12158.87 (8)Mo3—S—Mo272.26 (6)
S—Mo1—S1284.95 (7)Mo2—S1—Mo174.02 (6)
O41—Mo1—S1184.37 (14)Mo3—S2—Mo273.83 (6)
S1—Mo1—S1188.15 (8)Mo1—S3—Mo371.46 (6)
S3—Mo1—S1185.00 (7)P1—S11—Mo187.73 (10)
S—Mo1—S11159.85 (7)P1—S12—Mo187.87 (10)
S12—Mo1—S1178.05 (7)P2—S21—Mo286.58 (10)
O41—Mo1—Mo384.83 (13)P2—S22—Mo285.93 (10)
S1—Mo1—Mo398.92 (5)P3—S31—Mo387.03 (10)
S3—Mo1—Mo354.31 (5)P3—S32—Mo385.85 (10)
S—Mo1—Mo354.98 (5)O11—P1—O1296.3 (3)
S12—Mo1—Mo3139.16 (6)O11—P1—S11113.7 (3)
S11—Mo1—Mo3138.80 (6)O12—P1—S11113.7 (3)
O41—Mo1—Mo2134.70 (13)O11—P1—S12113.7 (3)
S1—Mo1—Mo252.81 (5)O12—P1—S12113.4 (3)
S3—Mo1—Mo297.21 (5)S11—P1—S12106.19 (12)
S—Mo1—Mo254.00 (5)O21—P2—O22100.0 (4)
S12—Mo1—Mo2103.90 (6)O21—P2—S21113.9 (3)
S11—Mo1—Mo2140.93 (6)O22—P2—S21108.1 (3)
Mo3—Mo1—Mo260.97 (2)O21—P2—S22112.0 (3)
O61—Mo2—S1168.80 (15)O22—P2—S22113.3 (3)
O61—Mo2—S287.40 (15)S21—P2—S22109.26 (13)
S1—Mo2—S297.65 (7)O32—P3—O31100.0 (4)
O61—Mo2—S82.53 (15)O32—P3—S32115.8 (3)
S1—Mo2—S105.62 (7)O31—P3—S32108.4 (3)
S2—Mo2—S104.90 (7)O32—P3—S31113.2 (3)
O61—Mo2—S2178.72 (15)O31—P3—S31112.0 (3)
S1—Mo2—S2194.02 (8)S32—P3—S31107.15 (13)
S2—Mo2—S21161.33 (8)C11—O11—P1121.6 (6)
S—Mo2—S2185.77 (7)C13—O12—P1122.4 (6)
O61—Mo2—S2284.04 (15)C23—O22—P2120.6 (7)
S1—Mo2—S2286.13 (7)C21—O21—P2120.8 (6)
S2—Mo2—S2288.15 (7)C22—C21—O21111.9 (10)
S—Mo2—S22160.76 (7)C31—O31—P3123.4 (8)
S21—Mo2—S2278.12 (7)C32—C31—O31118.4 (16)
O61—Mo2—Mo1136.19 (14)C33—O32—P3123.0 (6)
S1—Mo2—Mo153.16 (5)C41—O41—Mo1122.6 (5)
S2—Mo2—Mo198.17 (6)C41—O42—Mo3123.0 (5)
S—Mo2—Mo153.95 (5)C61—O61—Mo2132.9 (6)
S21—Mo2—Mo1100.49 (6)C43—N41—C49126.9 (7)
S22—Mo2—Mo1139.25 (6)C61—N61—C63118.5 (9)
O61—Mo2—Mo393.89 (14)C61—N61—C62126.5 (9)
S1—Mo2—Mo397.13 (6)C63—N61—C62115.0 (9)
S2—Mo2—Mo352.99 (5)O11—C11—C12109.3 (9)
S—Mo2—Mo353.87 (5)C14—C13—O12111.0 (11)
S21—Mo2—Mo3139.64 (6)C24—C23—O22113.9 (14)
S22—Mo2—Mo3141.13 (5)O32—C33—C34109.7 (8)
Mo1—Mo2—Mo358.35 (2)O41—C41—O42125.0 (7)
O42—Mo3—S2171.57 (13)O41—C41—C42117.3 (7)
O42—Mo3—S382.10 (14)O42—C41—C42117.7 (7)
S2—Mo3—S394.46 (7)C47—C42—C43119.2 (7)
O42—Mo3—S83.34 (13)C47—C42—C41119.0 (7)
S2—Mo3—S105.07 (7)C43—C42—C41121.7 (7)
S3—Mo3—S108.60 (7)N41—C43—C44122.7 (7)
O42—Mo3—S3182.13 (14)N41—C43—C42119.9 (7)
S2—Mo3—S3199.04 (8)C44—C43—C42117.4 (7)
S3—Mo3—S31158.25 (8)C45—C44—C43121.6 (8)
S—Mo3—S3184.28 (7)C44—C45—C46120.5 (8)
O42—Mo3—S3282.03 (13)C47—C46—C45119.7 (8)
S2—Mo3—S3290.04 (8)C46—C47—C42121.6 (8)
S3—Mo3—S3285.33 (7)C54—C49—C50118.3 (9)
S—Mo3—S32158.16 (8)C54—C49—N41123.6 (9)
S31—Mo3—S3277.73 (8)C50—C49—N41118.1 (9)
O42—Mo3—Mo184.12 (12)C51—C50—C49120.4 (12)
S2—Mo3—Mo1100.17 (6)C52—C51—C50120.8 (13)
S3—Mo3—Mo154.23 (5)C53—C52—C51119.0 (12)
S—Mo3—Mo154.93 (5)C52—C53—C54121.5 (12)
S31—Mo3—Mo1138.18 (6)C49—C54—C53120.0 (11)
S32—Mo3—Mo1138.68 (6)O61—C61—N61128.7 (9)
O42—Mo3—Mo2134.74 (12)
 

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