

Supporting information
![]() | Crystallographic Information File (CIF) https://doi.org/10.1107/S2414314623006570/hb4439sup1.cif |
![]() | Structure factor file (CIF format) https://doi.org/10.1107/S2414314623006570/hb4439Isup2.hkl |
CCDC reference: 2285076
Key indicators
Structure: I- Single-crystal X-ray study
- T = 296 K
- Mean
(C-C) = 0.005 Å
- R factor = 0.021
- wR factor = 0.051
- Data-to-parameter ratio = 19.6
checkCIF/PLATON results
No syntax errors found
Alert level C PLAT910_ALERT_3_C Missing # of FCF Reflection(s) Below Theta(Min). 5 Note PLAT934_ALERT_3_C Number of (Iobs-Icalc)/Sigma(W) > 10 Outliers .. 1 Check
Alert level G PLAT128_ALERT_4_G Alternate Setting for Input Space Group C2/c I2/a Note PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo1 --Se1 . 6.5 s.u. PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo1 --Se2 . 9.5 s.u. PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo1 --Se2_a . 8.8 s.u. PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo2 --Se1 . 6.5 s.u. PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo2 --Se2 . 6.5 s.u. PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mo2 --Se1_a . 7.5 s.u. PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.14 Ratio PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 6 Note PLAT941_ALERT_3_G Average HKL Measurement Multiplicity ........... 4.1 Low PLAT978_ALERT_2_G Number C-C Bonds with Positive Residual Density. 0 Info
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 2 ALERT level C = Check. Ensure it is not caused by an omission or oversight 11 ALERT level G = General information/check it is not something unexpected 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 7 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 3 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check
Data collection: RAPID AUTO (Rigaku, 2006); cell refinement: RAPID AUTO (Rigaku, 2006); data reduction: RAPID AUTO (Rigaku, 2006); program(s) used to solve structure: SIR97 (Altomare et al., 1999); program(s) used to refine structure: SHELXL2018/3 (Sheldrick, 2015); molecular graphics: CrystalStructure 4.0 (Rigaku, 2010); software used to prepare material for publication: CrystalStructure 4.0 (Rigaku, 2010).
[Mo4(C6H7)4Se4] | F(000) = 1904.00 |
Mr = 1016.09 | Dx = 2.673 Mg m−3 |
Monoclinic, C2/c | Mo Kα radiation, λ = 0.71075 Å |
a = 21.1820 (4) Å | Cell parameters from 10275 reflections |
b = 8.42496 (16) Å | θ = 3.2–27.5° |
c = 16.4482 (3) Å | µ = 7.72 mm−1 |
β = 120.6613 (7)° | T = 296 K |
V = 2524.93 (9) Å3 | Platelet, brown |
Z = 4 | 0.10 × 0.10 × 0.10 mm |
Rigaku R-AXIS RAPID diffractometer | 2617 reflections with F2 > 2.0σ(F2) |
Detector resolution: 10.000 pixels mm-1 | Rint = 0.040 |
ω scans | θmax = 27.5°, θmin = 3.3° |
Absorption correction: multi-scan (ABSCOR; Rigaku, 1995) | h = −24→27 |
Tmin = 0.201, Tmax = 0.462 | k = −10→10 |
11868 measured reflections | l = −21→21 |
2878 independent reflections |
Refinement on F2 | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.021 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.051 | H-atom parameters constrained |
S = 1.07 | w = 1/[σ2(Fo2) + (0.0168P)2 + 4.2366P] where P = (Fo2 + 2Fc2)/3 |
2878 reflections | (Δ/σ)max = 0.002 |
147 parameters | Δρmax = 0.49 e Å−3 |
0 restraints | Δρmin = −0.79 e Å−3 |
Primary atom site location: structure-invariant direct methods |
Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. |
Refinement. Refinement was performed using all reflections. The weighted R-factor (wR) and goodness of fit (S) are based on F2. R-factor (gt) are based on F. The threshold expression of F2 > 2.0 sigma(F2) is used only for calculating R-factor (gt). All hydrogen atoms were placed at calculated positions (C—H = 0.96–0.98 Å) and refined using a riding model with Uiso(H) = 1.2Ueq(C). |
x | y | z | Uiso*/Ueq | ||
Mo1 | −0.05709 (2) | 0.36774 (3) | 0.77761 (2) | 0.01956 (7) | |
Mo2 | 0.05898 (2) | 0.11729 (3) | 0.85272 (2) | 0.02062 (7) | |
Se1 | −0.07420 (2) | 0.07974 (3) | 0.78522 (2) | 0.02368 (8) | |
Se2 | 0.07609 (2) | 0.40514 (3) | 0.88225 (2) | 0.02324 (8) | |
C1 | −0.16873 (18) | 0.4032 (4) | 0.7760 (2) | 0.0334 (7) | |
C2 | −0.16199 (18) | 0.5254 (4) | 0.7228 (2) | 0.0317 (7) | |
H1 | −0.197372 | 0.548621 | 0.656343 | 0.038* | |
C3 | −0.1002 (2) | 0.6197 (4) | 0.7834 (2) | 0.0344 (7) | |
H2 | −0.086145 | 0.719615 | 0.766422 | 0.041* | |
C4 | −0.0688 (2) | 0.5553 (4) | 0.8753 (2) | 0.0350 (7) | |
H3 | −0.028235 | 0.601956 | 0.932877 | 0.042* | |
C5 | −0.10922 (19) | 0.4220 (4) | 0.8715 (2) | 0.0332 (7) | |
H4 | −0.101723 | 0.359419 | 0.925903 | 0.040* | |
C6 | 0.0722 (2) | −0.0631 (4) | 0.9693 (2) | 0.0380 (8) | |
H5 | 0.032142 | −0.108311 | 0.975354 | 0.046* | |
C7 | 0.1045 (2) | −0.1336 (4) | 0.9208 (2) | 0.0362 (8) | |
H6 | 0.090569 | −0.235528 | 0.887498 | 0.043* | |
C8 | 0.16702 (18) | −0.0398 (4) | 0.9400 (2) | 0.0335 (7) | |
C9 | 0.1704 (2) | 0.0874 (4) | 0.9965 (2) | 0.0381 (8) | |
H7 | 0.209754 | 0.166436 | 1.024598 | 0.046* | |
C10 | 0.1123 (2) | 0.0738 (4) | 1.0150 (2) | 0.0401 (9) | |
H8 | 0.105439 | 0.139947 | 1.058922 | 0.048* | |
C11 | −0.2285 (2) | 0.2840 (5) | 0.7442 (3) | 0.0524 (10) | |
H9 | −0.213781 | 0.202041 | 0.791047 | 0.063* | |
H10 | −0.238348 | 0.238212 | 0.685470 | 0.063* | |
H11 | −0.272079 | 0.334778 | 0.735713 | 0.063* | |
C12 | 0.2244 (2) | −0.0779 (5) | 0.9148 (3) | 0.0509 (10) | |
H12 | 0.250562 | 0.017026 | 0.917858 | 0.061* | |
H13 | 0.201080 | −0.120411 | 0.851841 | 0.061* | |
H14 | 0.258069 | −0.154750 | 0.958472 | 0.061* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Mo1 | 0.02236 (13) | 0.01507 (12) | 0.01911 (12) | 0.00142 (9) | 0.00902 (10) | −0.00024 (9) |
Mo2 | 0.02366 (13) | 0.01577 (12) | 0.01921 (12) | 0.00191 (9) | 0.00860 (10) | 0.00260 (9) |
Se1 | 0.02711 (16) | 0.01821 (15) | 0.02549 (15) | −0.00290 (11) | 0.01325 (12) | 0.00020 (11) |
Se2 | 0.02603 (16) | 0.01916 (14) | 0.01959 (14) | −0.00302 (11) | 0.00805 (12) | −0.00285 (11) |
C1 | 0.0301 (17) | 0.0359 (18) | 0.0375 (17) | 0.0050 (14) | 0.0196 (14) | −0.0026 (14) |
C2 | 0.0305 (17) | 0.0322 (17) | 0.0314 (16) | 0.0127 (14) | 0.0151 (13) | 0.0036 (14) |
C3 | 0.042 (2) | 0.0175 (14) | 0.0447 (19) | 0.0097 (14) | 0.0232 (16) | 0.0006 (14) |
C4 | 0.0388 (19) | 0.0307 (17) | 0.0322 (16) | 0.0051 (14) | 0.0157 (14) | −0.0109 (14) |
C5 | 0.0404 (19) | 0.0358 (18) | 0.0283 (15) | 0.0116 (15) | 0.0210 (14) | 0.0031 (14) |
C6 | 0.044 (2) | 0.0360 (19) | 0.0345 (17) | 0.0073 (15) | 0.0200 (15) | 0.0200 (15) |
C7 | 0.046 (2) | 0.0199 (15) | 0.0370 (17) | 0.0100 (14) | 0.0169 (16) | 0.0127 (13) |
C8 | 0.0306 (17) | 0.0340 (18) | 0.0287 (15) | 0.0130 (14) | 0.0099 (13) | 0.0145 (14) |
C9 | 0.0344 (19) | 0.0376 (19) | 0.0261 (15) | 0.0056 (15) | 0.0036 (14) | 0.0067 (14) |
C10 | 0.051 (2) | 0.041 (2) | 0.0208 (14) | 0.0139 (17) | 0.0122 (15) | 0.0095 (14) |
C11 | 0.039 (2) | 0.055 (2) | 0.068 (3) | −0.0036 (19) | 0.031 (2) | −0.006 (2) |
C12 | 0.046 (2) | 0.052 (2) | 0.052 (2) | 0.0155 (19) | 0.0230 (19) | 0.0129 (19) |
Mo1—C3 | 2.332 (3) | C2—C3 | 1.416 (5) |
Mo1—C2 | 2.339 (3) | C2—H1 | 0.9800 |
Mo1—C4 | 2.355 (3) | C3—C4 | 1.413 (5) |
Mo1—C5 | 2.356 (3) | C3—H2 | 0.9800 |
Mo1—C1 | 2.370 (3) | C4—C5 | 1.394 (5) |
Mo1—Se2 | 2.4633 (4) | C4—H3 | 0.9800 |
Mo1—Se1 | 2.4659 (4) | C5—H4 | 0.9800 |
Mo1—Se2i | 2.4689 (3) | C6—C10 | 1.402 (5) |
Mo1—Mo1i | 2.9857 (5) | C6—C7 | 1.419 (5) |
Mo1—Mo2 | 2.9875 (3) | C6—H5 | 0.9800 |
Mo1—Mo2i | 2.9935 (3) | C7—C8 | 1.432 (5) |
Mo2—C10 | 2.337 (3) | C7—H6 | 0.9800 |
Mo2—C6 | 2.350 (3) | C8—C9 | 1.396 (5) |
Mo2—C9 | 2.352 (3) | C8—C12 | 1.506 (5) |
Mo2—C7 | 2.356 (3) | C9—C10 | 1.414 (5) |
Mo2—C8 | 2.387 (3) | C9—H7 | 0.9800 |
Mo2—Se2 | 2.4635 (4) | C10—H8 | 0.9800 |
Mo2—Se1 | 2.4691 (4) | C11—H9 | 0.9600 |
Mo2—Se1i | 2.4692 (4) | C11—H10 | 0.9600 |
Mo2—Mo2i | 3.0083 (5) | C11—H11 | 0.9600 |
C1—C2 | 1.404 (5) | C12—H12 | 0.9600 |
C1—C5 | 1.435 (5) | C12—H13 | 0.9600 |
C1—C11 | 1.487 (5) | C12—H14 | 0.9600 |
C3—Mo1—C2 | 35.30 (12) | C7—Mo2—Mo1i | 145.65 (9) |
C3—Mo1—C4 | 35.09 (12) | C8—Mo2—Mo1i | 118.70 (8) |
C2—Mo1—C4 | 58.11 (11) | Se2—Mo2—Mo1i | 52.718 (9) |
C3—Mo1—C5 | 58.16 (12) | Se1—Mo2—Mo1i | 99.982 (11) |
C2—Mo1—C5 | 58.09 (11) | Se1i—Mo2—Mo1i | 52.606 (9) |
C4—Mo1—C5 | 34.41 (12) | Mo1—Mo2—Mo1i | 59.894 (10) |
C3—Mo1—C1 | 58.43 (12) | C10—Mo2—Mo2i | 157.50 (10) |
C2—Mo1—C1 | 34.69 (12) | C6—Mo2—Mo2i | 127.01 (9) |
C4—Mo1—C1 | 58.08 (12) | C9—Mo2—Mo2i | 164.17 (9) |
C5—Mo1—C1 | 35.36 (11) | C7—Mo2—Mo2i | 115.98 (9) |
C3—Mo1—Se2 | 100.84 (9) | C8—Mo2—Mo2i | 131.90 (8) |
C2—Mo1—Se2 | 136.14 (9) | Se2—Mo2—Mo2i | 100.132 (8) |
C4—Mo1—Se2 | 85.36 (9) | Se1—Mo2—Mo2i | 52.472 (10) |
C5—Mo1—Se2 | 105.65 (9) | Se1i—Mo2—Mo2i | 52.471 (10) |
C1—Mo1—Se2 | 140.55 (8) | Mo1—Mo2—Mo2i | 59.902 (8) |
C3—Mo1—Se1 | 145.37 (9) | Mo1i—Mo2—Mo2i | 59.705 (8) |
C2—Mo1—Se1 | 116.29 (9) | Mo1—Se1—Mo2 | 74.510 (12) |
C4—Mo1—Se1 | 123.79 (9) | Mo1—Se1—Mo2i | 74.684 (11) |
C5—Mo1—Se1 | 91.58 (9) | Mo2—Se1—Mo2i | 75.060 (13) |
C1—Mo1—Se1 | 87.30 (8) | Mo1—Se2—Mo2 | 74.656 (12) |
Se2—Mo1—Se1 | 103.651 (13) | Mo1—Se2—Mo1i | 74.507 (12) |
C3—Mo1—Se2i | 94.16 (9) | Mo2—Se2—Mo1i | 74.730 (11) |
C2—Mo1—Se2i | 84.87 (8) | C2—C1—C5 | 106.8 (3) |
C4—Mo1—Se2i | 128.63 (9) | C2—C1—C11 | 128.0 (3) |
C5—Mo1—Se2i | 142.82 (8) | C5—C1—C11 | 125.1 (3) |
C1—Mo1—Se2i | 110.62 (8) | C2—C1—Mo1 | 71.44 (19) |
Se2—Mo1—Se2i | 103.560 (13) | C5—C1—Mo1 | 71.77 (18) |
Se1—Mo1—Se2i | 103.372 (13) | C11—C1—Mo1 | 125.8 (2) |
C3—Mo1—Mo1i | 114.04 (9) | C1—C2—C3 | 108.9 (3) |
C2—Mo1—Mo1i | 129.84 (8) | C1—C2—Mo1 | 73.87 (18) |
C4—Mo1—Mo1i | 126.24 (9) | C3—C2—Mo1 | 72.07 (17) |
C5—Mo1—Mo1i | 157.28 (9) | C1—C2—H1 | 125.4 |
C1—Mo1—Mo1i | 162.73 (8) | C3—C2—H1 | 125.4 |
Se2—Mo1—Mo1i | 52.834 (10) | Mo1—C2—H1 | 125.4 |
Se1—Mo1—Mo1i | 100.268 (9) | C4—C3—C2 | 107.4 (3) |
Se2i—Mo1—Mo1i | 52.659 (10) | C4—C3—Mo1 | 73.37 (18) |
C3—Mo1—Mo2 | 152.01 (9) | C2—C3—Mo1 | 72.64 (17) |
C2—Mo1—Mo2 | 168.55 (9) | C4—C3—H2 | 126.0 |
C4—Mo1—Mo2 | 122.87 (8) | C2—C3—H2 | 126.0 |
C5—Mo1—Mo2 | 115.34 (8) | Mo1—C3—H2 | 126.0 |
C1—Mo1—Mo2 | 134.39 (8) | C5—C4—C3 | 108.5 (3) |
Se2—Mo1—Mo2 | 52.676 (10) | C5—C4—Mo1 | 72.81 (18) |
Se1—Mo1—Mo2 | 52.794 (10) | C3—C4—Mo1 | 71.54 (17) |
Se2i—Mo1—Mo2 | 100.565 (11) | C5—C4—H3 | 125.6 |
Mo1i—Mo1—Mo2 | 60.153 (8) | C3—C4—H3 | 125.6 |
C3—Mo1—Mo2i | 143.92 (9) | Mo1—C4—H3 | 125.6 |
C2—Mo1—Mo2i | 117.47 (8) | C4—C5—C1 | 108.4 (3) |
C4—Mo1—Mo2i | 173.63 (9) | C4—C5—Mo1 | 72.78 (18) |
C5—Mo1—Mo2i | 140.04 (9) | C1—C5—Mo1 | 72.87 (17) |
C1—Mo1—Mo2i | 115.58 (8) | C4—C5—H4 | 125.6 |
Se2—Mo1—Mo2i | 100.539 (11) | C1—C5—H4 | 125.6 |
Se1—Mo1—Mo2i | 52.709 (9) | Mo1—C5—H4 | 125.6 |
Se2i—Mo1—Mo2i | 52.551 (9) | C10—C6—C7 | 108.1 (3) |
Mo1i—Mo1—Mo2i | 59.954 (8) | C10—C6—Mo2 | 72.11 (18) |
Mo2—Mo1—Mo2i | 60.394 (10) | C7—C6—Mo2 | 72.68 (17) |
C10—Mo2—C6 | 34.82 (13) | C10—C6—H5 | 125.8 |
C10—Mo2—C9 | 35.10 (13) | C7—C6—H5 | 125.8 |
C6—Mo2—C9 | 57.92 (13) | Mo2—C6—H5 | 125.8 |
C10—Mo2—C7 | 58.26 (13) | C6—C7—C8 | 107.6 (3) |
C6—Mo2—C7 | 35.11 (12) | C6—C7—Mo2 | 72.22 (18) |
C9—Mo2—C7 | 57.88 (13) | C8—C7—Mo2 | 73.65 (18) |
C10—Mo2—C8 | 57.94 (12) | C6—C7—H6 | 126.0 |
C6—Mo2—C8 | 58.10 (12) | C8—C7—H6 | 126.0 |
C9—Mo2—C8 | 34.26 (12) | Mo2—C7—H6 | 126.0 |
C7—Mo2—C8 | 35.14 (12) | C9—C8—C7 | 107.3 (3) |
C10—Mo2—Se2 | 89.56 (9) | C9—C8—C12 | 125.0 (3) |
C6—Mo2—Se2 | 122.11 (9) | C7—C8—C12 | 127.4 (3) |
C9—Mo2—Se2 | 86.33 (9) | C9—C8—Mo2 | 71.47 (18) |
C7—Mo2—Se2 | 143.71 (9) | C7—C8—Mo2 | 71.21 (18) |
C8—Mo2—Se2 | 115.33 (9) | C12—C8—Mo2 | 127.8 (2) |
C10—Mo2—Se1 | 105.64 (10) | C8—C9—C10 | 109.1 (3) |
C6—Mo2—Se1 | 85.26 (9) | C8—C9—Mo2 | 74.27 (18) |
C9—Mo2—Se1 | 140.23 (9) | C10—C9—Mo2 | 71.88 (18) |
C7—Mo2—Se1 | 101.27 (9) | C8—C9—H7 | 125.3 |
C8—Mo2—Se1 | 136.41 (9) | C10—C9—H7 | 125.3 |
Se2—Mo2—Se1 | 103.549 (13) | Mo2—C9—H7 | 125.3 |
C10—Mo2—Se1i | 144.67 (10) | C6—C10—C9 | 107.9 (3) |
C6—Mo2—Se1i | 130.55 (9) | C6—C10—Mo2 | 73.08 (18) |
C9—Mo2—Se1i | 112.09 (9) | C9—C10—Mo2 | 73.01 (18) |
C7—Mo2—Se1i | 96.22 (9) | C6—C10—H8 | 125.8 |
C8—Mo2—Se1i | 86.98 (8) | C9—C10—H8 | 125.8 |
Se2—Mo2—Se1i | 103.434 (13) | Mo2—C10—H8 | 125.8 |
Se1—Mo2—Se1i | 103.004 (13) | C1—C11—H9 | 109.5 |
C10—Mo2—Mo1 | 113.56 (9) | C1—C11—H10 | 109.5 |
C6—Mo2—Mo1 | 121.66 (9) | H9—C11—H10 | 109.5 |
C9—Mo2—Mo1 | 133.12 (9) | C1—C11—H11 | 109.5 |
C7—Mo2—Mo1 | 151.79 (9) | H9—C11—H11 | 109.5 |
C8—Mo2—Mo1 | 167.07 (9) | H10—C11—H11 | 109.5 |
Se2—Mo2—Mo1 | 52.668 (10) | C8—C12—H12 | 109.5 |
Se1—Mo2—Mo1 | 52.696 (9) | C8—C12—H13 | 109.5 |
Se1i—Mo2—Mo1 | 100.141 (11) | H12—C12—H13 | 109.5 |
C10—Mo2—Mo1i | 138.65 (10) | C8—C12—H14 | 109.5 |
C6—Mo2—Mo1i | 173.27 (10) | H12—C12—H14 | 109.5 |
C9—Mo2—Mo1i | 115.84 (9) | H13—C12—H14 | 109.5 |
C5—C1—C2—C3 | −0.5 (4) | C10—C6—C7—C8 | 1.8 (4) |
C11—C1—C2—C3 | 174.6 (3) | Mo2—C6—C7—C8 | 65.7 (2) |
Mo1—C1—C2—C3 | −64.0 (2) | C10—C6—C7—Mo2 | −63.8 (2) |
C5—C1—C2—Mo1 | 63.5 (2) | C6—C7—C8—C9 | −2.0 (3) |
C11—C1—C2—Mo1 | −121.4 (4) | Mo2—C7—C8—C9 | 62.8 (2) |
C1—C2—C3—C4 | −0.5 (4) | C6—C7—C8—C12 | 171.5 (3) |
Mo1—C2—C3—C4 | −65.7 (2) | Mo2—C7—C8—C12 | −123.7 (3) |
C1—C2—C3—Mo1 | 65.2 (2) | C6—C7—C8—Mo2 | −64.7 (2) |
C2—C3—C4—C5 | 1.3 (4) | C7—C8—C9—C10 | 1.3 (3) |
Mo1—C3—C4—C5 | −63.9 (2) | C12—C8—C9—C10 | −172.4 (3) |
C2—C3—C4—Mo1 | 65.2 (2) | Mo2—C8—C9—C10 | 63.9 (2) |
C3—C4—C5—C1 | −1.6 (4) | C7—C8—C9—Mo2 | −62.6 (2) |
Mo1—C4—C5—C1 | −64.7 (2) | C12—C8—C9—Mo2 | 123.7 (3) |
C3—C4—C5—Mo1 | 63.0 (2) | C7—C6—C10—C9 | −1.0 (4) |
C2—C1—C5—C4 | 1.3 (4) | Mo2—C6—C10—C9 | −65.2 (2) |
C11—C1—C5—C4 | −173.9 (3) | C7—C6—C10—Mo2 | 64.2 (2) |
Mo1—C1—C5—C4 | 64.6 (2) | C8—C9—C10—C6 | −0.2 (4) |
C2—C1—C5—Mo1 | −63.3 (2) | Mo2—C9—C10—C6 | 65.3 (2) |
C11—C1—C5—Mo1 | 121.4 (3) | C8—C9—C10—Mo2 | −65.5 (2) |
Symmetry code: (i) −x, y, −z+3/2. |