| Literature DB >> 22719325 |
Abstract
In the title compound, {[Lu(NO(3))(2)(C(6)H(18)N(3)OP)(4)][AgWS(4)]}(n), hexa-methyl-phospho-ramide (hmp), tetra-thio-tungstate, silver iodide and lutetium nitrate were self-assembled, forming an anionic {[AgWS(4)](-)}(n) chain extending parallel to [001]. The Lu(III) atom in the cation is coordinated by eight O atoms from two nitrate groups and four hmp ligands in a distorted square-anti-prismatic geometry. Together with the two nitrate groups, the cation is monovalent, which leads to the anionic chain having a [WS(4)Ag] repeat unit. The polymeric anionic chain has a distorted linear configuration with W-Ag-W and Ag-W-Ag angles of 161.66 (2) and 153.503 (12)°, respectively. The title complex is isotypic with the Y, Yb, Eu, Nd, La, Dy and Sm analogues.Entities:
Year: 2012 PMID: 22719325 PMCID: PMC3379104 DOI: 10.1107/S1600536812020983
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Lu(NO3)2(C6H18N3OP)4][AgWS4] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 14630 reflections |
| θ = 3.0–29.1° | |
| µ = 4.74 mm−1 | |
| β = 90.54 (3)° | Block, orange |
| 0.21 × 0.15 × 0.12 mm | |
| Rigaku Saturn724+ diffractometer | 9613 independent reflections |
| Radiation source: fine-focus sealed tube | 8961 reflections with |
| Graphite monochromator | |
| ω scans | θmax = 25.4°, θmin = 3.0° |
| Absorption correction: multi-scan ( | |
| 26979 measured reflections |
| Refinement on | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| Hydrogen site location: inferred from neighbouring sites | |
| H-atom parameters constrained | |
| 9613 reflections | (Δ/σ)max = 0.001 |
| 532 parameters | Δρmax = 1.35 e Å−3 |
| 0 restraints | Δρmin = −1.46 e Å−3 |
| 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 |
| Lu1 | 0.238835 (16) | 0.082664 (9) | 0.82761 (3) | 0.02424 (8) | |
| P1 | 0.02402 (11) | 0.13199 (6) | 0.81901 (17) | 0.0313 (4) | |
| P2 | 0.20044 (12) | −0.02970 (6) | 0.70329 (18) | 0.0335 (4) | |
| P3 | 0.45726 (11) | 0.09618 (6) | 0.73055 (18) | 0.0328 (4) | |
| P4 | 0.29341 (14) | 0.14657 (7) | 1.09306 (19) | 0.0420 (5) | |
| O1 | 0.1061 (3) | 0.10628 (15) | 0.8222 (4) | 0.0312 (11) | |
| O2 | 0.2079 (3) | 0.01909 (14) | 0.7318 (4) | 0.0313 (11) | |
| O3 | 0.3745 (3) | 0.08059 (15) | 0.7786 (5) | 0.0346 (12) | |
| O4 | 0.2722 (3) | 0.12599 (15) | 0.9777 (4) | 0.0337 (11) | |
| O5 | 0.2536 (3) | 0.15769 (15) | 0.7411 (5) | 0.0356 (12) | |
| O6 | 0.2249 (3) | 0.10224 (15) | 0.6230 (4) | 0.0353 (11) | |
| O7 | 0.2285 (4) | 0.1716 (2) | 0.5563 (5) | 0.0651 (18) | |
| O8 | 0.3020 (3) | 0.02779 (15) | 0.9615 (5) | 0.0366 (12) | |
| O9 | 0.1691 (3) | 0.04180 (16) | 0.9851 (5) | 0.0360 (12) | |
| O10 | 0.2374 (4) | 0.00153 (19) | 1.1157 (5) | 0.0559 (16) | |
| N1 | 0.2363 (4) | 0.1452 (2) | 0.6380 (6) | 0.0401 (15) | |
| N2 | 0.2366 (4) | 0.02294 (19) | 1.0234 (6) | 0.0357 (14) | |
| N3 | −0.0539 (3) | 0.0967 (2) | 0.8464 (6) | 0.0362 (14) | |
| N4 | 0.0232 (4) | 0.1731 (2) | 0.9157 (6) | 0.0478 (18) | |
| N5 | 0.0093 (4) | 0.1550 (2) | 0.6918 (6) | 0.0500 (18) | |
| N6 | 0.1064 (4) | −0.0476 (2) | 0.7424 (6) | 0.0477 (18) | |
| N7 | 0.2218 (4) | −0.0359 (2) | 0.5618 (6) | 0.0407 (15) | |
| N8 | 0.2662 (4) | −0.0648 (2) | 0.7683 (6) | 0.0469 (17) | |
| N9 | 0.5329 (4) | 0.0698 (2) | 0.8016 (6) | 0.0492 (18) | |
| N10 | 0.4550 (4) | 0.0869 (2) | 0.5876 (6) | 0.0508 (18) | |
| N11 | 0.4832 (4) | 0.1491 (2) | 0.7387 (7) | 0.054 (2) | |
| N12 | 0.3944 (5) | 0.1388 (3) | 1.1227 (8) | 0.073 (3) | |
| N13 | 0.2725 (5) | 0.2007 (2) | 1.0903 (6) | 0.056 (2) | |
| N14 | 0.2394 (6) | 0.1242 (3) | 1.1946 (7) | 0.070 (2) | |
| C1 | −0.1417 (5) | 0.1059 (3) | 0.8091 (8) | 0.054 (2) | |
| H1A | −0.1778 | 0.0814 | 0.8332 | 0.081* | |
| H1B | −0.1442 | 0.1088 | 0.7251 | 0.081* | |
| H1C | −0.1608 | 0.1336 | 0.8445 | 0.081* | |
| C2 | −0.0450 (5) | 0.0644 (3) | 0.9441 (7) | 0.045 (2) | |
| H2A | −0.0953 | 0.0462 | 0.9489 | 0.068* | |
| H2B | −0.0371 | 0.0808 | 1.0163 | 0.068* | |
| H2C | 0.0034 | 0.0453 | 0.9309 | 0.068* | |
| C3 | −0.0461 (6) | 0.1832 (3) | 0.9949 (9) | 0.063 (3) | |
| H3A | −0.0314 | 0.2090 | 1.0422 | 0.095* | |
| H3B | −0.0560 | 0.1575 | 1.0449 | 0.095* | |
| H3C | −0.0967 | 0.1896 | 0.9500 | 0.095* | |
| C4 | 0.0899 (6) | 0.2078 (3) | 0.9141 (10) | 0.073 (3) | |
| H4A | 0.0799 | 0.2294 | 0.9754 | 0.109* | |
| H4B | 0.0891 | 0.2229 | 0.8394 | 0.109* | |
| H4C | 0.1444 | 0.1937 | 0.9263 | 0.109* | |
| C5 | −0.0347 (6) | 0.1988 (4) | 0.6740 (11) | 0.092 (4) | |
| H5A | −0.0367 | 0.2058 | 0.5917 | 0.137* | |
| H5B | −0.0043 | 0.2222 | 0.7152 | 0.137* | |
| H5C | −0.0916 | 0.1967 | 0.7037 | 0.137* | |
| C6 | 0.0217 (6) | 0.1284 (5) | 0.5869 (9) | 0.089 (4) | |
| H6A | 0.0103 | 0.1467 | 0.5189 | 0.133* | |
| H6B | −0.0164 | 0.1029 | 0.5872 | 0.133* | |
| H6C | 0.0794 | 0.1178 | 0.5849 | 0.133* | |
| C7 | 0.0349 (5) | −0.0171 (3) | 0.7493 (10) | 0.063 (3) | |
| H7A | −0.0147 | −0.0336 | 0.7725 | 0.095* | |
| H7B | 0.0250 | −0.0035 | 0.6738 | 0.095* | |
| H7C | 0.0470 | 0.0062 | 0.8061 | 0.095* | |
| C8 | 0.0812 (7) | −0.0950 (3) | 0.7221 (9) | 0.076 (3) | |
| H8A | 0.0241 | −0.0995 | 0.7490 | 0.114* | |
| H8B | 0.1192 | −0.1147 | 0.7645 | 0.114* | |
| H8C | 0.0840 | −0.1016 | 0.6396 | 0.114* | |
| C9 | 0.1964 (6) | −0.0015 (3) | 0.4784 (8) | 0.060 (2) | |
| H9A | 0.2138 | −0.0103 | 0.4011 | 0.090* | |
| H9B | 0.2228 | 0.0267 | 0.4991 | 0.090* | |
| H9C | 0.1357 | 0.0019 | 0.4796 | 0.090* | |
| C10 | 0.2270 (6) | −0.0819 (3) | 0.5112 (8) | 0.061 (3) | |
| H10A | 0.2395 | −0.0798 | 0.4290 | 0.091* | |
| H10B | 0.1737 | −0.0972 | 0.5214 | 0.091* | |
| H10C | 0.2714 | −0.0986 | 0.5505 | 0.091* | |
| C11 | 0.2564 (7) | −0.0811 (3) | 0.8850 (10) | 0.081 (3) | |
| H11A | 0.3029 | −0.1010 | 0.9044 | 0.121* | |
| H11B | 0.2037 | −0.0974 | 0.8908 | 0.121* | |
| H11C | 0.2561 | −0.0560 | 0.9387 | 0.121* | |
| C12 | 0.3551 (6) | −0.0675 (4) | 0.7344 (12) | 0.093 (4) | |
| H12A | 0.3837 | −0.0896 | 0.7823 | 0.139* | |
| H12B | 0.3816 | −0.0384 | 0.7454 | 0.139* | |
| H12C | 0.3586 | −0.0761 | 0.6533 | 0.139* | |
| C13 | 0.5197 (5) | 0.0278 (3) | 0.8603 (10) | 0.071 (3) | |
| H13A | 0.5721 | 0.0181 | 0.8964 | 0.107* | |
| H13B | 0.5010 | 0.0054 | 0.8046 | 0.107* | |
| H13C | 0.4772 | 0.0316 | 0.9195 | 0.107* | |
| C14 | 0.6230 (5) | 0.0792 (4) | 0.7778 (10) | 0.092 (4) | |
| H14A | 0.6581 | 0.0604 | 0.8274 | 0.138* | |
| H14B | 0.6349 | 0.1105 | 0.7938 | 0.138* | |
| H14C | 0.6348 | 0.0727 | 0.6969 | 0.138* | |
| C15 | 0.4059 (6) | 0.0484 (3) | 0.5418 (9) | 0.060 (2) | |
| H15A | 0.4108 | 0.0473 | 0.4578 | 0.090* | |
| H15B | 0.3472 | 0.0520 | 0.5625 | 0.090* | |
| H15C | 0.4276 | 0.0208 | 0.5752 | 0.090* | |
| C16 | 0.5274 (7) | 0.0983 (4) | 0.5151 (9) | 0.092 (4) | |
| H16A | 0.5151 | 0.0905 | 0.4347 | 0.138* | |
| H16B | 0.5765 | 0.0817 | 0.5417 | 0.138* | |
| H16C | 0.5386 | 0.1302 | 0.5208 | 0.138* | |
| C17 | 0.5150 (8) | 0.1682 (4) | 0.8498 (10) | 0.099 (5) | |
| H17A | 0.5273 | 0.1998 | 0.8393 | 0.148* | |
| H17B | 0.5660 | 0.1526 | 0.8735 | 0.148* | |
| H17C | 0.4726 | 0.1647 | 0.9094 | 0.148* | |
| C18 | 0.4520 (6) | 0.1835 (3) | 0.6577 (12) | 0.084 (4) | |
| H18A | 0.4752 | 0.2125 | 0.6795 | 0.126* | |
| H18B | 0.3910 | 0.1848 | 0.6608 | 0.126* | |
| H18C | 0.4693 | 0.1761 | 0.5793 | 0.126* | |
| C19 | 0.4350 (6) | 0.0961 (4) | 1.1099 (11) | 0.086 (4) | |
| H19A | 0.4938 | 0.0986 | 1.1328 | 0.129* | |
| H19B | 0.4312 | 0.0865 | 1.0294 | 0.129* | |
| H19C | 0.4075 | 0.0742 | 1.1590 | 0.129* | |
| C20 | 0.4496 (8) | 0.1728 (4) | 1.1820 (13) | 0.114 (5) | |
| H20A | 0.5060 | 0.1608 | 1.1910 | 0.171* | |
| H20B | 0.4269 | 0.1797 | 1.2580 | 0.171* | |
| H20C | 0.4515 | 0.1999 | 1.1355 | 0.171* | |
| C21 | 0.3023 (6) | 0.2276 (3) | 0.9914 (8) | 0.053 (2) | |
| H21A | 0.2856 | 0.2587 | 1.0019 | 0.080* | |
| H21B | 0.2778 | 0.2162 | 0.9198 | 0.080* | |
| H21C | 0.3632 | 0.2258 | 0.9874 | 0.080* | |
| C22 | 0.2472 (8) | 0.2263 (3) | 1.1945 (9) | 0.089 (4) | |
| H22A | 0.2383 | 0.2574 | 1.1737 | 0.133* | |
| H22B | 0.2912 | 0.2243 | 1.2534 | 0.133* | |
| H22C | 0.1954 | 0.2139 | 1.2250 | 0.133* | |
| C23 | 0.1475 (7) | 0.1212 (4) | 1.1831 (10) | 0.090 (4) | |
| H23A | 0.1246 | 0.1070 | 1.2518 | 0.135* | |
| H23B | 0.1331 | 0.1035 | 1.1150 | 0.135* | |
| H23C | 0.1240 | 0.1511 | 1.1749 | 0.135* | |
| C24 | 0.2759 (11) | 0.1062 (5) | 1.3055 (10) | 0.131 (6) | |
| H24A | 0.2311 | 0.0945 | 1.3534 | 0.197* | |
| H24B | 0.3047 | 0.1302 | 1.3469 | 0.197* | |
| H24C | 0.3155 | 0.0825 | 1.2881 | 0.197* | |
| W1 | 0.717054 (16) | 0.272631 (8) | −0.02951 (2) | 0.02209 (8) | |
| Ag1 | 0.71827 (4) | 0.234532 (19) | 0.21013 (5) | 0.03906 (15) | |
| S1 | 0.71534 (12) | 0.31578 (6) | 0.12878 (15) | 0.0323 (4) | |
| S2 | 0.71713 (12) | 0.19938 (6) | 0.01126 (16) | 0.0354 (4) | |
| S3 | 0.83194 (11) | 0.28867 (7) | −0.13097 (17) | 0.0370 (4) | |
| S4 | 0.60299 (11) | 0.28773 (7) | −0.13470 (17) | 0.0386 (4) |
| Lu1 | 0.02144 (14) | 0.01924 (14) | 0.03204 (17) | −0.00058 (10) | −0.00007 (12) | −0.00116 (12) |
| P1 | 0.0226 (9) | 0.0375 (10) | 0.0338 (11) | 0.0063 (7) | −0.0011 (8) | 0.0040 (9) |
| P2 | 0.0357 (10) | 0.0240 (9) | 0.0408 (12) | −0.0047 (7) | 0.0058 (9) | −0.0060 (8) |
| P3 | 0.0205 (8) | 0.0332 (10) | 0.0446 (12) | −0.0026 (7) | 0.0030 (8) | 0.0073 (9) |
| P4 | 0.0573 (13) | 0.0304 (10) | 0.0379 (12) | −0.0103 (9) | −0.0165 (10) | −0.0015 (9) |
| O1 | 0.023 (2) | 0.033 (3) | 0.037 (3) | 0.0044 (19) | −0.002 (2) | −0.002 (2) |
| O2 | 0.032 (3) | 0.023 (2) | 0.039 (3) | −0.0048 (19) | −0.001 (2) | −0.004 (2) |
| O3 | 0.025 (2) | 0.033 (3) | 0.046 (3) | −0.0040 (19) | 0.007 (2) | 0.004 (2) |
| O4 | 0.035 (3) | 0.026 (2) | 0.039 (3) | −0.004 (2) | −0.009 (2) | −0.008 (2) |
| O5 | 0.044 (3) | 0.027 (3) | 0.035 (3) | −0.005 (2) | −0.001 (2) | 0.001 (2) |
| O6 | 0.043 (3) | 0.028 (3) | 0.035 (3) | −0.003 (2) | 0.003 (2) | −0.001 (2) |
| O7 | 0.105 (5) | 0.051 (4) | 0.039 (4) | −0.015 (3) | −0.015 (3) | 0.020 (3) |
| O8 | 0.026 (2) | 0.032 (3) | 0.052 (3) | −0.001 (2) | 0.000 (2) | 0.007 (2) |
| O9 | 0.030 (3) | 0.033 (3) | 0.045 (3) | −0.003 (2) | 0.003 (2) | 0.002 (2) |
| O10 | 0.058 (4) | 0.056 (4) | 0.054 (4) | −0.004 (3) | −0.002 (3) | 0.029 (3) |
| N1 | 0.043 (4) | 0.033 (4) | 0.044 (4) | −0.001 (3) | −0.002 (3) | 0.004 (3) |
| N2 | 0.035 (3) | 0.026 (3) | 0.045 (4) | −0.002 (3) | −0.003 (3) | 0.003 (3) |
| N3 | 0.027 (3) | 0.042 (4) | 0.040 (4) | 0.001 (3) | 0.000 (3) | 0.006 (3) |
| N4 | 0.036 (4) | 0.046 (4) | 0.062 (5) | 0.006 (3) | 0.012 (3) | −0.009 (4) |
| N5 | 0.038 (4) | 0.066 (5) | 0.046 (4) | −0.001 (3) | −0.002 (3) | 0.021 (4) |
| N6 | 0.043 (4) | 0.038 (4) | 0.062 (5) | −0.016 (3) | 0.015 (3) | −0.020 (3) |
| N7 | 0.048 (4) | 0.036 (3) | 0.038 (4) | −0.007 (3) | 0.007 (3) | −0.005 (3) |
| N8 | 0.063 (4) | 0.030 (3) | 0.049 (4) | 0.009 (3) | 0.012 (4) | 0.003 (3) |
| N9 | 0.027 (3) | 0.060 (4) | 0.060 (5) | 0.002 (3) | 0.004 (3) | 0.032 (4) |
| N10 | 0.042 (4) | 0.067 (5) | 0.044 (4) | −0.015 (3) | 0.007 (3) | 0.007 (4) |
| N11 | 0.039 (4) | 0.038 (4) | 0.085 (6) | −0.007 (3) | 0.008 (4) | 0.004 (4) |
| N12 | 0.079 (6) | 0.054 (5) | 0.086 (7) | −0.021 (4) | −0.055 (5) | −0.002 (5) |
| N13 | 0.096 (6) | 0.034 (4) | 0.039 (4) | −0.011 (4) | −0.004 (4) | −0.009 (3) |
| N14 | 0.104 (7) | 0.053 (5) | 0.052 (5) | −0.029 (4) | −0.006 (5) | 0.006 (4) |
| C1 | 0.034 (4) | 0.075 (6) | 0.052 (6) | 0.000 (4) | −0.004 (4) | 0.013 (5) |
| C2 | 0.036 (4) | 0.050 (5) | 0.050 (5) | 0.001 (3) | 0.008 (4) | 0.005 (4) |
| C3 | 0.064 (6) | 0.045 (5) | 0.082 (8) | 0.020 (4) | 0.025 (5) | −0.006 (5) |
| C4 | 0.068 (6) | 0.046 (5) | 0.104 (9) | −0.004 (5) | 0.016 (6) | −0.019 (6) |
| C5 | 0.064 (7) | 0.095 (8) | 0.115 (10) | 0.012 (6) | −0.007 (6) | 0.077 (8) |
| C6 | 0.056 (6) | 0.171 (12) | 0.039 (6) | −0.017 (7) | −0.006 (5) | −0.001 (7) |
| C7 | 0.042 (5) | 0.057 (6) | 0.092 (8) | −0.007 (4) | −0.003 (5) | 0.003 (6) |
| C8 | 0.093 (8) | 0.054 (6) | 0.081 (8) | −0.045 (5) | 0.030 (6) | −0.023 (6) |
| C9 | 0.078 (7) | 0.059 (6) | 0.042 (5) | −0.006 (5) | 0.000 (5) | −0.010 (5) |
| C10 | 0.080 (6) | 0.045 (5) | 0.058 (6) | −0.015 (4) | 0.020 (5) | −0.027 (5) |
| C11 | 0.105 (9) | 0.057 (6) | 0.081 (8) | 0.028 (6) | 0.006 (7) | 0.020 (6) |
| C12 | 0.065 (7) | 0.093 (8) | 0.120 (11) | 0.024 (6) | 0.008 (7) | 0.016 (8) |
| C13 | 0.034 (5) | 0.062 (6) | 0.117 (10) | 0.007 (4) | 0.012 (5) | 0.036 (6) |
| C14 | 0.026 (4) | 0.140 (10) | 0.110 (9) | −0.002 (5) | 0.006 (5) | 0.088 (8) |
| C15 | 0.055 (5) | 0.068 (6) | 0.058 (6) | 0.002 (5) | 0.003 (5) | −0.005 (5) |
| C16 | 0.073 (7) | 0.142 (11) | 0.060 (7) | −0.042 (7) | 0.020 (6) | 0.011 (7) |
| C17 | 0.116 (10) | 0.088 (8) | 0.094 (9) | −0.064 (7) | 0.046 (8) | −0.049 (7) |
| C18 | 0.052 (6) | 0.043 (5) | 0.158 (12) | 0.002 (4) | 0.008 (6) | 0.049 (7) |
| C19 | 0.064 (7) | 0.074 (7) | 0.119 (11) | 0.005 (5) | −0.046 (7) | 0.016 (7) |
| C20 | 0.123 (11) | 0.094 (9) | 0.124 (12) | −0.044 (8) | −0.065 (9) | −0.002 (9) |
| C21 | 0.080 (6) | 0.036 (5) | 0.043 (5) | −0.012 (4) | 0.007 (5) | 0.001 (4) |
| C22 | 0.156 (12) | 0.055 (6) | 0.055 (7) | −0.020 (6) | 0.029 (7) | −0.021 (5) |
| C23 | 0.110 (9) | 0.094 (8) | 0.066 (8) | −0.046 (7) | 0.038 (7) | −0.011 (6) |
| C24 | 0.223 (18) | 0.125 (12) | 0.045 (7) | 0.019 (11) | 0.012 (9) | 0.041 (8) |
| W1 | 0.02831 (14) | 0.02062 (14) | 0.01730 (14) | 0.00242 (10) | −0.00181 (10) | −0.00090 (10) |
| Ag1 | 0.0615 (4) | 0.0361 (3) | 0.0195 (3) | −0.0005 (3) | −0.0008 (3) | 0.0021 (2) |
| S1 | 0.0505 (11) | 0.0232 (9) | 0.0231 (9) | −0.0008 (7) | −0.0008 (8) | −0.0063 (7) |
| S2 | 0.0579 (12) | 0.0204 (8) | 0.0280 (10) | 0.0045 (8) | −0.0013 (8) | −0.0028 (7) |
| S3 | 0.0350 (10) | 0.0480 (11) | 0.0281 (10) | −0.0060 (8) | 0.0023 (8) | −0.0013 (9) |
| S4 | 0.0345 (10) | 0.0521 (12) | 0.0290 (10) | 0.0163 (8) | −0.0073 (8) | −0.0039 (9) |
| Lu1—O4 | 2.193 (5) | C6—H6A | 0.9600 |
| Lu1—O1 | 2.199 (4) | C6—H6B | 0.9600 |
| Lu1—O3 | 2.210 (4) | C6—H6C | 0.9600 |
| Lu1—O2 | 2.221 (4) | C7—H7A | 0.9600 |
| Lu1—O6 | 2.407 (5) | C7—H7B | 0.9600 |
| Lu1—O8 | 2.429 (5) | C7—H7C | 0.9600 |
| Lu1—O9 | 2.429 (5) | C8—H8A | 0.9600 |
| Lu1—O5 | 2.435 (5) | C8—H8B | 0.9600 |
| Lu1—N1 | 2.838 (7) | C8—H8C | 0.9600 |
| Lu1—N2 | 2.841 (6) | C9—H9A | 0.9600 |
| P1—O1 | 1.497 (4) | C9—H9B | 0.9600 |
| P1—N5 | 1.613 (7) | C9—H9C | 0.9600 |
| P1—N4 | 1.637 (7) | C10—H10A | 0.9600 |
| P1—N3 | 1.640 (6) | C10—H10B | 0.9600 |
| P2—O2 | 1.480 (5) | C10—H10C | 0.9600 |
| P2—N8 | 1.634 (7) | C11—H11A | 0.9600 |
| P2—N6 | 1.635 (6) | C11—H11B | 0.9600 |
| P2—N7 | 1.658 (7) | C11—H11C | 0.9600 |
| P3—O3 | 1.488 (4) | C12—H12A | 0.9600 |
| P3—N11 | 1.615 (7) | C12—H12B | 0.9600 |
| P3—N9 | 1.630 (6) | C12—H12C | 0.9600 |
| P3—N10 | 1.650 (7) | C13—H13A | 0.9600 |
| P4—O4 | 1.482 (5) | C13—H13B | 0.9600 |
| P4—N14 | 1.585 (8) | C13—H13C | 0.9600 |
| P4—N13 | 1.631 (7) | C14—H14A | 0.9600 |
| P4—N12 | 1.635 (8) | C14—H14B | 0.9600 |
| O5—N1 | 1.257 (8) | C14—H14C | 0.9600 |
| O6—N1 | 1.290 (7) | C15—H15A | 0.9600 |
| O7—N1 | 1.219 (8) | C15—H15B | 0.9600 |
| O8—N2 | 1.260 (7) | C15—H15C | 0.9600 |
| O9—N2 | 1.270 (7) | C16—H16A | 0.9600 |
| O10—N2 | 1.225 (8) | C16—H16B | 0.9600 |
| N3—C1 | 1.465 (9) | C16—H16C | 0.9600 |
| N3—C2 | 1.470 (10) | C17—H17A | 0.9600 |
| N4—C3 | 1.452 (10) | C17—H17B | 0.9600 |
| N4—C4 | 1.465 (10) | C17—H17C | 0.9600 |
| N5—C6 | 1.444 (12) | C18—H18A | 0.9600 |
| N5—C5 | 1.477 (11) | C18—H18B | 0.9600 |
| N6—C7 | 1.441 (10) | C18—H18C | 0.9600 |
| N6—C8 | 1.470 (10) | C19—H19A | 0.9600 |
| N7—C9 | 1.442 (11) | C19—H19B | 0.9600 |
| N7—C10 | 1.477 (9) | C19—H19C | 0.9600 |
| N8—C11 | 1.423 (12) | C20—H20A | 0.9600 |
| N8—C12 | 1.455 (11) | C20—H20B | 0.9600 |
| N9—C13 | 1.423 (10) | C20—H20C | 0.9600 |
| N9—C14 | 1.470 (9) | C21—H21A | 0.9600 |
| N10—C16 | 1.452 (10) | C21—H21B | 0.9600 |
| N10—C15 | 1.464 (11) | C21—H21C | 0.9600 |
| N11—C18 | 1.455 (11) | C22—H22A | 0.9600 |
| N11—C17 | 1.468 (13) | C22—H22B | 0.9600 |
| N12—C19 | 1.422 (12) | C22—H22C | 0.9600 |
| N12—C20 | 1.484 (12) | C23—H23A | 0.9600 |
| N13—C21 | 1.459 (10) | C23—H23B | 0.9600 |
| N13—C22 | 1.464 (11) | C23—H23C | 0.9600 |
| N14—C23 | 1.451 (13) | C24—H24A | 0.9600 |
| N14—C24 | 1.479 (14) | C24—H24B | 0.9600 |
| C1—H1A | 0.9600 | C24—H24C | 0.9600 |
| C1—H1B | 0.9600 | W1—S4 | 2.1917 (19) |
| C1—H1C | 0.9600 | W1—S3 | 2.2034 (18) |
| C2—H2A | 0.9600 | W1—S1 | 2.2059 (17) |
| C2—H2B | 0.9600 | W1—S2 | 2.2105 (17) |
| C2—H2C | 0.9600 | W1—Ag1 | 2.9492 (8) |
| C3—H3A | 0.9600 | W1—Ag1i | 2.9701 (8) |
| C3—H3B | 0.9600 | Ag1—S2 | 2.4890 (19) |
| C3—H3C | 0.9600 | Ag1—S1 | 2.5699 (18) |
| C4—H4A | 0.9600 | Ag1—S3ii | 2.621 (2) |
| C4—H4B | 0.9600 | Ag1—S4ii | 2.625 (2) |
| C4—H4C | 0.9600 | Ag1—W1ii | 2.9701 (8) |
| C5—H5A | 0.9600 | S3—Ag1i | 2.621 (2) |
| C5—H5B | 0.9600 | S4—Ag1i | 2.625 (2) |
| C5—H5C | 0.9600 | ||
| O4—Lu1—O1 | 93.25 (17) | N5—C5—H5C | 109.5 |
| O4—Lu1—O3 | 89.36 (18) | H5A—C5—H5C | 109.5 |
| O1—Lu1—O3 | 156.72 (17) | H5B—C5—H5C | 109.5 |
| O4—Lu1—O2 | 157.54 (18) | N5—C6—H6A | 109.5 |
| O1—Lu1—O2 | 92.89 (16) | N5—C6—H6B | 109.5 |
| O3—Lu1—O2 | 93.46 (17) | H6A—C6—H6B | 109.5 |
| O4—Lu1—O6 | 129.22 (17) | N5—C6—H6C | 109.5 |
| O1—Lu1—O6 | 79.56 (17) | H6A—C6—H6C | 109.5 |
| O3—Lu1—O6 | 80.90 (18) | H6B—C6—H6C | 109.5 |
| O2—Lu1—O6 | 73.18 (16) | N6—C7—H7A | 109.5 |
| O4—Lu1—O8 | 78.87 (17) | N6—C7—H7B | 109.5 |
| O1—Lu1—O8 | 127.65 (16) | H7A—C7—H7B | 109.5 |
| O3—Lu1—O8 | 75.54 (16) | N6—C7—H7C | 109.5 |
| O2—Lu1—O8 | 80.28 (17) | H7A—C7—H7C | 109.5 |
| O6—Lu1—O8 | 143.11 (16) | H7B—C7—H7C | 109.5 |
| O4—Lu1—O9 | 79.69 (17) | N6—C8—H8A | 109.5 |
| O1—Lu1—O9 | 75.17 (17) | N6—C8—H8B | 109.5 |
| O3—Lu1—O9 | 127.97 (17) | H8A—C8—H8B | 109.5 |
| O2—Lu1—O9 | 81.05 (17) | N6—C8—H8C | 109.5 |
| O6—Lu1—O9 | 142.66 (16) | H8A—C8—H8C | 109.5 |
| O8—Lu1—O9 | 52.48 (15) | H8B—C8—H8C | 109.5 |
| O4—Lu1—O5 | 76.22 (18) | N7—C9—H9A | 109.5 |
| O1—Lu1—O5 | 78.13 (16) | N7—C9—H9B | 109.5 |
| O3—Lu1—O5 | 80.06 (16) | H9A—C9—H9B | 109.5 |
| O2—Lu1—O5 | 126.22 (17) | N7—C9—H9C | 109.5 |
| O6—Lu1—O5 | 53.04 (16) | H9A—C9—H9C | 109.5 |
| O8—Lu1—O5 | 145.06 (16) | H9B—C9—H9C | 109.5 |
| O9—Lu1—O5 | 142.63 (16) | N7—C10—H10A | 109.5 |
| O4—Lu1—N1 | 102.39 (19) | N7—C10—H10B | 109.5 |
| O1—Lu1—N1 | 76.47 (17) | H10A—C10—H10B | 109.5 |
| O3—Lu1—N1 | 80.37 (18) | N7—C10—H10C | 109.5 |
| O2—Lu1—N1 | 100.05 (18) | H10A—C10—H10C | 109.5 |
| O6—Lu1—N1 | 26.90 (17) | H10B—C10—H10C | 109.5 |
| O8—Lu1—N1 | 155.87 (16) | N8—C11—H11A | 109.5 |
| O9—Lu1—N1 | 151.64 (17) | N8—C11—H11B | 109.5 |
| O5—Lu1—N1 | 26.18 (16) | H11A—C11—H11B | 109.5 |
| O4—Lu1—N2 | 75.86 (18) | N8—C11—H11C | 109.5 |
| O1—Lu1—N2 | 101.52 (17) | H11A—C11—H11C | 109.5 |
| O3—Lu1—N2 | 101.54 (17) | H11B—C11—H11C | 109.5 |
| O2—Lu1—N2 | 81.75 (17) | N8—C12—H12A | 109.5 |
| O6—Lu1—N2 | 154.92 (16) | N8—C12—H12B | 109.5 |
| O8—Lu1—N2 | 26.21 (15) | H12A—C12—H12B | 109.5 |
| O9—Lu1—N2 | 26.44 (15) | N8—C12—H12C | 109.5 |
| O5—Lu1—N2 | 152.00 (17) | H12A—C12—H12C | 109.5 |
| N1—Lu1—N2 | 177.33 (18) | H12B—C12—H12C | 109.5 |
| O1—P1—N5 | 110.6 (3) | N9—C13—H13A | 109.5 |
| O1—P1—N4 | 111.8 (3) | N9—C13—H13B | 109.5 |
| N5—P1—N4 | 106.8 (4) | H13A—C13—H13B | 109.5 |
| O1—P1—N3 | 108.6 (3) | N9—C13—H13C | 109.5 |
| N5—P1—N3 | 109.6 (3) | H13A—C13—H13C | 109.5 |
| N4—P1—N3 | 109.4 (3) | H13B—C13—H13C | 109.5 |
| O2—P2—N8 | 117.9 (3) | N9—C14—H14A | 109.5 |
| O2—P2—N6 | 108.9 (3) | N9—C14—H14B | 109.5 |
| N8—P2—N6 | 104.0 (4) | H14A—C14—H14B | 109.5 |
| O2—P2—N7 | 107.7 (3) | N9—C14—H14C | 109.5 |
| N8—P2—N7 | 103.7 (3) | H14A—C14—H14C | 109.5 |
| N6—P2—N7 | 114.8 (3) | H14B—C14—H14C | 109.5 |
| O3—P3—N11 | 119.9 (3) | N10—C15—H15A | 109.5 |
| O3—P3—N9 | 107.8 (3) | N10—C15—H15B | 109.5 |
| N11—P3—N9 | 104.5 (4) | H15A—C15—H15B | 109.5 |
| O3—P3—N10 | 107.5 (3) | N10—C15—H15C | 109.5 |
| N11—P3—N10 | 102.7 (4) | H15A—C15—H15C | 109.5 |
| N9—P3—N10 | 114.7 (4) | H15B—C15—H15C | 109.5 |
| O4—P4—N14 | 111.0 (4) | N10—C16—H16A | 109.5 |
| O4—P4—N13 | 109.9 (3) | N10—C16—H16B | 109.5 |
| N14—P4—N13 | 108.2 (4) | H16A—C16—H16B | 109.5 |
| O4—P4—N12 | 109.6 (4) | N10—C16—H16C | 109.5 |
| N14—P4—N12 | 108.5 (5) | H16A—C16—H16C | 109.5 |
| N13—P4—N12 | 109.6 (4) | H16B—C16—H16C | 109.5 |
| P1—O1—Lu1 | 168.0 (3) | N11—C17—H17A | 109.5 |
| P2—O2—Lu1 | 161.0 (3) | N11—C17—H17B | 109.5 |
| P3—O3—Lu1 | 158.9 (3) | H17A—C17—H17B | 109.5 |
| P4—O4—Lu1 | 168.3 (3) | N11—C17—H17C | 109.5 |
| N1—O5—Lu1 | 95.1 (4) | H17A—C17—H17C | 109.5 |
| N1—O6—Lu1 | 95.5 (4) | H17B—C17—H17C | 109.5 |
| N2—O8—Lu1 | 95.5 (4) | N11—C18—H18A | 109.5 |
| N2—O9—Lu1 | 95.2 (4) | N11—C18—H18B | 109.5 |
| O7—N1—O5 | 122.9 (6) | H18A—C18—H18B | 109.5 |
| O7—N1—O6 | 120.9 (7) | N11—C18—H18C | 109.5 |
| O5—N1—O6 | 116.1 (6) | H18A—C18—H18C | 109.5 |
| O7—N1—Lu1 | 175.0 (5) | H18B—C18—H18C | 109.5 |
| O5—N1—Lu1 | 58.7 (3) | N12—C19—H19A | 109.5 |
| O6—N1—Lu1 | 57.6 (3) | N12—C19—H19B | 109.5 |
| O10—N2—O8 | 122.3 (6) | H19A—C19—H19B | 109.5 |
| O10—N2—O9 | 121.5 (6) | N12—C19—H19C | 109.5 |
| O8—N2—O9 | 116.2 (6) | H19A—C19—H19C | 109.5 |
| O10—N2—Lu1 | 172.6 (5) | H19B—C19—H19C | 109.5 |
| O8—N2—Lu1 | 58.3 (3) | N12—C20—H20A | 109.5 |
| O9—N2—Lu1 | 58.4 (3) | N12—C20—H20B | 109.5 |
| C1—N3—C2 | 115.0 (6) | H20A—C20—H20B | 109.5 |
| C1—N3—P1 | 122.0 (5) | N12—C20—H20C | 109.5 |
| C2—N3—P1 | 119.2 (5) | H20A—C20—H20C | 109.5 |
| C3—N4—C4 | 113.9 (7) | H20B—C20—H20C | 109.5 |
| C3—N4—P1 | 125.4 (6) | N13—C21—H21A | 109.5 |
| C4—N4—P1 | 119.9 (6) | N13—C21—H21B | 109.5 |
| C6—N5—C5 | 115.4 (9) | H21A—C21—H21B | 109.5 |
| C6—N5—P1 | 119.5 (7) | N13—C21—H21C | 109.5 |
| C5—N5—P1 | 123.6 (7) | H21A—C21—H21C | 109.5 |
| C7—N6—C8 | 113.2 (7) | H21B—C21—H21C | 109.5 |
| C7—N6—P2 | 121.3 (6) | N13—C22—H22A | 109.5 |
| C8—N6—P2 | 120.4 (6) | N13—C22—H22B | 109.5 |
| C9—N7—C10 | 114.0 (7) | H22A—C22—H22B | 109.5 |
| C9—N7—P2 | 120.2 (5) | N13—C22—H22C | 109.5 |
| C10—N7—P2 | 119.5 (5) | H22A—C22—H22C | 109.5 |
| C11—N8—C12 | 109.9 (8) | H22B—C22—H22C | 109.5 |
| C11—N8—P2 | 124.3 (6) | N14—C23—H23A | 109.5 |
| C12—N8—P2 | 121.3 (6) | N14—C23—H23B | 109.5 |
| C13—N9—C14 | 113.3 (6) | H23A—C23—H23B | 109.5 |
| C13—N9—P3 | 122.7 (5) | N14—C23—H23C | 109.5 |
| C14—N9—P3 | 121.2 (5) | H23A—C23—H23C | 109.5 |
| C16—N10—C15 | 113.0 (8) | H23B—C23—H23C | 109.5 |
| C16—N10—P3 | 120.8 (6) | N14—C24—H24A | 109.5 |
| C15—N10—P3 | 119.0 (6) | N14—C24—H24B | 109.5 |
| C18—N11—C17 | 112.7 (8) | H24A—C24—H24B | 109.5 |
| C18—N11—P3 | 123.8 (7) | N14—C24—H24C | 109.5 |
| C17—N11—P3 | 120.4 (7) | H24A—C24—H24C | 109.5 |
| C19—N12—C20 | 112.6 (9) | H24B—C24—H24C | 109.5 |
| C19—N12—P4 | 122.6 (6) | S4—W1—S3 | 109.89 (7) |
| C20—N12—P4 | 124.2 (8) | S4—W1—S1 | 108.20 (7) |
| C21—N13—C22 | 115.8 (7) | S3—W1—S1 | 108.67 (7) |
| C21—N13—P4 | 118.8 (6) | S4—W1—S2 | 108.19 (8) |
| C22—N13—P4 | 123.0 (7) | S3—W1—S2 | 108.73 (7) |
| C23—N14—C24 | 115.6 (9) | S1—W1—S2 | 113.13 (7) |
| C23—N14—P4 | 120.0 (7) | S4—W1—Ag1 | 125.49 (6) |
| C24—N14—P4 | 124.4 (9) | S3—W1—Ag1 | 124.61 (6) |
| N3—C1—H1A | 109.5 | S1—W1—Ag1 | 57.67 (5) |
| N3—C1—H1B | 109.5 | S2—W1—Ag1 | 55.48 (5) |
| H1A—C1—H1B | 109.5 | S4—W1—Ag1i | 58.85 (5) |
| N3—C1—H1C | 109.5 | S3—W1—Ag1i | 58.65 (6) |
| H1A—C1—H1C | 109.5 | S1—W1—Ag1i | 148.83 (5) |
| H1B—C1—H1C | 109.5 | S2—W1—Ag1i | 98.03 (5) |
| N3—C2—H2A | 109.5 | Ag1—W1—Ag1i | 153.503 (12) |
| N3—C2—H2B | 109.5 | S2—Ag1—S1 | 93.51 (6) |
| H2A—C2—H2B | 109.5 | S2—Ag1—S3ii | 121.16 (6) |
| N3—C2—H2C | 109.5 | S1—Ag1—S3ii | 120.13 (6) |
| H2A—C2—H2C | 109.5 | S2—Ag1—S4ii | 120.53 (7) |
| H2B—C2—H2C | 109.5 | S1—Ag1—S4ii | 117.74 (6) |
| N4—C3—H3A | 109.5 | S3ii—Ag1—S4ii | 86.61 (6) |
| N4—C3—H3B | 109.5 | S2—Ag1—W1 | 47.03 (4) |
| H3A—C3—H3B | 109.5 | S1—Ag1—W1 | 46.49 (4) |
| N4—C3—H3C | 109.5 | S3ii—Ag1—W1 | 137.38 (5) |
| H3A—C3—H3C | 109.5 | S4ii—Ag1—W1 | 135.95 (5) |
| H3B—C3—H3C | 109.5 | S2—Ag1—W1ii | 151.28 (5) |
| N4—C4—H4A | 109.5 | S1—Ag1—W1ii | 115.17 (4) |
| N4—C4—H4B | 109.5 | S3ii—Ag1—W1ii | 45.90 (4) |
| H4A—C4—H4B | 109.5 | S4ii—Ag1—W1ii | 45.61 (4) |
| N4—C4—H4C | 109.5 | W1—Ag1—W1ii | 161.66 (2) |
| H4A—C4—H4C | 109.5 | W1—S1—Ag1 | 75.84 (5) |
| H4B—C4—H4C | 109.5 | W1—S2—Ag1 | 77.49 (5) |
| N5—C5—H5A | 109.5 | W1—S3—Ag1i | 75.45 (6) |
| N5—C5—H5B | 109.5 | W1—S4—Ag1i | 75.54 (6) |
| H5A—C5—H5B | 109.5 |