| Literature DB >> 21201985 |
Shou-Bin Wang, Hong-Mei He, Sheng Li, Kun Tang.
Abstract
In the title compound, [Gd(2)(C(7)H(3)F(2)O(2))(6)(C(12)H(8)N(2))(2)], the asymmetric unit comprises one Gd(3+) cation chelated by two 2,4-difluoro-benzoate and one 1,10-phenanthroline ligands. Two cations are linked into a centrosymmetric dimer via three bridging carboxyl-ate groups of 2,4-difluoro-benzoate ligands. Each Gd(3+) ion is nine-coordinated by seven O atoms and two N atoms.Entities:
Year: 2008 PMID: 21201985 PMCID: PMC2960912 DOI: 10.1107/S1600536808004431
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Gd2(C7H3F2O2)6(C12H8N2)2] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2yn | Cell parameters from 5535 reflections |
| θ = 2.1–25.5º | |
| µ = 2.31 mm−1 | |
| β = 109.364 (2)º | Block, colourless |
| 0.33 × 0.14 × 0.08 mm | |
| Bruker APEXII CCD area-detector diffractometer | 5535 independent reflections |
| Radiation source: fine-focus sealed tube | 4598 reflections with |
| Monochromator: graphite | |
| θmax = 25.5º | |
| φ and ω scans | θmin = 2.1º |
| Absorption correction: multi-scan(SADABS; Bruker, 2001) | |
| 15634 measured reflections |
| Refinement on | Secondary atom site location: difference Fourier map |
| Least-squares matrix: full | Hydrogen site location: inferred from neighbouring sites |
| H-atom parameters constrained | |
| | |
| (Δ/σ)max = 0.008 | |
| 5535 reflections | Δρmax = 1.69 e Å−3 |
| 433 parameters | Δρmin = −0.64 e Å−3 |
| Primary atom site location: structure-invariant direct methods | Extinction correction: none |
| 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 |
| Gd1 | 0.997885 (14) | 0.144628 (14) | 0.957975 (13) | 0.02862 (9) | |
| C1 | 1.1346 (3) | 0.2166 (3) | 0.8849 (3) | 0.0373 (10) | |
| C2 | 1.2110 (3) | 0.2446 (3) | 0.8476 (3) | 0.0428 (11) | |
| C3 | 1.1982 (4) | 0.2280 (4) | 0.7539 (4) | 0.0530 (13) | |
| H3 | 1.1411 | 0.2041 | 0.7152 | 0.064* | |
| C4 | 1.2694 (5) | 0.2467 (5) | 0.7181 (4) | 0.0725 (19) | |
| H4 | 1.2606 | 0.2353 | 0.6558 | 0.087* | |
| C5 | 1.3513 (5) | 0.2816 (5) | 0.7747 (5) | 0.076 (2) | |
| C6 | 1.3667 (5) | 0.2995 (6) | 0.8637 (6) | 0.095 (3) | |
| H6 | 1.4243 | 0.3240 | 0.9009 | 0.113* | |
| C7 | 1.2965 (4) | 0.2815 (5) | 0.9009 (4) | 0.0667 (17) | |
| C8 | 0.9247 (3) | −0.0549 (3) | 0.8221 (3) | 0.0316 (9) | |
| C9 | 0.9086 (3) | −0.0732 (3) | 0.7207 (3) | 0.0328 (9) | |
| C10 | 0.9380 (3) | −0.0029 (3) | 0.6705 (3) | 0.0413 (11) | |
| H10 | 0.9713 | 0.0512 | 0.7013 | 0.050* | |
| C11 | 0.9189 (4) | −0.0117 (4) | 0.5764 (3) | 0.0573 (14) | |
| H11 | 0.9399 | 0.0351 | 0.5437 | 0.069* | |
| C12 | 0.8686 (5) | −0.0904 (5) | 0.5324 (3) | 0.0656 (17) | |
| C13 | 0.8377 (4) | −0.1626 (4) | 0.5768 (3) | 0.0541 (14) | |
| H13 | 0.8030 | −0.2153 | 0.5446 | 0.065* | |
| C14 | 0.8605 (3) | −0.1536 (3) | 0.6721 (3) | 0.0407 (11) | |
| C15 | 0.8390 (3) | 0.0592 (3) | 1.0120 (3) | 0.0344 (9) | |
| C16 | 0.7585 (3) | 0.0448 (3) | 1.0482 (3) | 0.0422 (11) | |
| C17 | 0.7753 (5) | 0.0095 (4) | 1.1374 (4) | 0.0631 (16) | |
| H17 | 0.8347 | −0.0130 | 1.1717 | 0.076* | |
| C18 | 0.7040 (6) | 0.0075 (5) | 1.1760 (5) | 0.085 (2) | |
| H18 | 0.7150 | −0.0182 | 1.2350 | 0.102* | |
| C19 | 0.6197 (6) | 0.0427 (6) | 1.1277 (6) | 0.092 (3) | |
| C20 | 0.5978 (4) | 0.0755 (5) | 1.0382 (5) | 0.0761 (19) | |
| H20 | 0.5378 | 0.0968 | 1.0048 | 0.091* | |
| C21 | 0.6685 (4) | 0.0755 (4) | 0.9998 (4) | 0.0532 (13) | |
| C22 | 0.9877 (4) | 0.3346 (4) | 1.1111 (3) | 0.0454 (12) | |
| H22 | 1.0244 | 0.2895 | 1.1532 | 0.054* | |
| C23 | 0.9628 (4) | 0.4212 (4) | 1.1453 (4) | 0.0553 (14) | |
| H23 | 0.9809 | 0.4318 | 1.2089 | 0.066* | |
| C24 | 0.9121 (4) | 0.4896 (4) | 1.0857 (4) | 0.0548 (14) | |
| H24 | 0.8961 | 0.5479 | 1.1082 | 0.066* | |
| C25 | 0.8838 (3) | 0.4726 (3) | 0.9899 (4) | 0.0440 (11) | |
| C26 | 0.9099 (3) | 0.3819 (3) | 0.9608 (3) | 0.0371 (10) | |
| C27 | 0.8324 (4) | 0.5425 (4) | 0.9223 (4) | 0.0569 (15) | |
| H27 | 0.8156 | 0.6020 | 0.9418 | 0.068* | |
| C28 | 0.8081 (4) | 0.5232 (4) | 0.8309 (4) | 0.0547 (14) | |
| H28 | 0.7764 | 0.5704 | 0.7882 | 0.066* | |
| C29 | 0.8303 (3) | 0.4316 (3) | 0.7986 (4) | 0.0452 (11) | |
| C30 | 0.8798 (3) | 0.3602 (3) | 0.8629 (3) | 0.0361 (10) | |
| C31 | 0.8017 (4) | 0.4072 (4) | 0.7045 (4) | 0.0551 (14) | |
| H31 | 0.7696 | 0.4526 | 0.6600 | 0.066* | |
| C32 | 0.8213 (4) | 0.3157 (5) | 0.6782 (4) | 0.0598 (15) | |
| H32 | 0.8018 | 0.2980 | 0.6160 | 0.072* | |
| C33 | 0.8708 (4) | 0.2504 (4) | 0.7466 (3) | 0.0480 (12) | |
| H33 | 0.8836 | 0.1887 | 0.7281 | 0.058* | |
| F1 | 1.3151 (4) | 0.3046 (6) | 0.9873 (4) | 0.153 (3) | |
| F2 | 1.4208 (3) | 0.3002 (4) | 0.7394 (4) | 0.133 (2) | |
| F3 | 0.8319 (2) | −0.2247 (2) | 0.71639 (19) | 0.0520 (7) | |
| F4 | 0.8467 (4) | −0.0971 (4) | 0.4386 (2) | 0.1107 (16) | |
| F5 | 0.6472 (2) | 0.1067 (3) | 0.9116 (2) | 0.0688 (9) | |
| F6 | 0.5496 (4) | 0.0443 (4) | 1.1648 (4) | 0.141 (2) | |
| N1 | 0.9615 (2) | 0.3134 (3) | 1.0209 (2) | 0.0331 (8) | |
| N2 | 0.9010 (3) | 0.2706 (3) | 0.8367 (2) | 0.0355 (8) | |
| O1 | 1.1385 (2) | 0.2404 (3) | 0.9662 (2) | 0.0486 (8) | |
| O2 | 1.0671 (2) | 0.1674 (2) | 0.8334 (2) | 0.0418 (7) | |
| O3 | 0.9197 (2) | 0.0335 (2) | 0.84238 (19) | 0.0360 (7) | |
| O4 | 0.9422 (2) | −0.1250 (2) | 0.8774 (2) | 0.0398 (7) | |
| O5 | 0.8436 (2) | 0.1391 (2) | 0.9743 (2) | 0.0440 (8) | |
| O6 | 0.8994 (2) | −0.0069 (2) | 1.0241 (2) | 0.0449 (8) |
| Gd1 | 0.03159 (14) | 0.02662 (13) | 0.02902 (13) | −0.00158 (8) | 0.01190 (9) | −0.00349 (8) |
| C1 | 0.043 (3) | 0.030 (2) | 0.045 (3) | −0.0028 (19) | 0.022 (2) | −0.0029 (19) |
| C2 | 0.046 (3) | 0.036 (3) | 0.055 (3) | −0.009 (2) | 0.029 (2) | −0.006 (2) |
| C3 | 0.060 (3) | 0.056 (3) | 0.054 (3) | −0.016 (3) | 0.034 (3) | −0.004 (2) |
| C4 | 0.087 (5) | 0.082 (5) | 0.071 (4) | −0.032 (4) | 0.056 (4) | −0.020 (3) |
| C5 | 0.075 (4) | 0.088 (5) | 0.094 (5) | −0.041 (4) | 0.065 (4) | −0.042 (4) |
| C6 | 0.060 (4) | 0.118 (7) | 0.118 (6) | −0.048 (4) | 0.047 (4) | −0.043 (5) |
| C7 | 0.062 (4) | 0.089 (5) | 0.058 (3) | −0.031 (3) | 0.031 (3) | −0.033 (3) |
| C8 | 0.028 (2) | 0.033 (2) | 0.034 (2) | −0.0040 (17) | 0.0107 (17) | −0.0075 (18) |
| C9 | 0.034 (2) | 0.034 (2) | 0.028 (2) | 0.0058 (18) | 0.0075 (17) | −0.0058 (17) |
| C10 | 0.049 (3) | 0.039 (3) | 0.039 (2) | 0.005 (2) | 0.020 (2) | −0.002 (2) |
| C11 | 0.081 (4) | 0.058 (3) | 0.042 (3) | 0.010 (3) | 0.032 (3) | 0.006 (3) |
| C12 | 0.095 (5) | 0.072 (4) | 0.031 (3) | 0.014 (3) | 0.021 (3) | −0.009 (3) |
| C13 | 0.067 (4) | 0.054 (3) | 0.034 (3) | 0.004 (3) | 0.006 (2) | −0.019 (2) |
| C14 | 0.046 (3) | 0.035 (3) | 0.038 (2) | 0.008 (2) | 0.011 (2) | −0.0043 (19) |
| C15 | 0.031 (2) | 0.040 (2) | 0.033 (2) | 0.0016 (19) | 0.0113 (18) | −0.0068 (19) |
| C16 | 0.047 (3) | 0.031 (2) | 0.057 (3) | −0.001 (2) | 0.029 (2) | −0.001 (2) |
| C17 | 0.089 (5) | 0.047 (3) | 0.071 (4) | 0.018 (3) | 0.051 (3) | 0.011 (3) |
| C18 | 0.117 (6) | 0.069 (4) | 0.103 (5) | 0.022 (4) | 0.081 (5) | 0.028 (4) |
| C19 | 0.104 (6) | 0.080 (5) | 0.134 (7) | 0.002 (4) | 0.095 (6) | 0.020 (5) |
| C20 | 0.049 (3) | 0.073 (4) | 0.120 (6) | −0.006 (3) | 0.047 (4) | 0.006 (4) |
| C21 | 0.044 (3) | 0.044 (3) | 0.079 (4) | −0.006 (2) | 0.030 (3) | 0.005 (3) |
| C22 | 0.053 (3) | 0.041 (3) | 0.045 (3) | −0.003 (2) | 0.020 (2) | −0.010 (2) |
| C23 | 0.065 (3) | 0.055 (3) | 0.056 (3) | −0.012 (3) | 0.033 (3) | −0.024 (3) |
| C24 | 0.057 (3) | 0.038 (3) | 0.078 (4) | −0.004 (2) | 0.034 (3) | −0.023 (3) |
| C25 | 0.035 (2) | 0.031 (2) | 0.070 (3) | −0.0048 (19) | 0.023 (2) | −0.010 (2) |
| C26 | 0.030 (2) | 0.032 (2) | 0.053 (3) | −0.0045 (18) | 0.018 (2) | −0.006 (2) |
| C27 | 0.044 (3) | 0.029 (3) | 0.095 (5) | 0.004 (2) | 0.019 (3) | −0.006 (3) |
| C28 | 0.040 (3) | 0.036 (3) | 0.082 (4) | 0.003 (2) | 0.012 (3) | 0.011 (3) |
| C29 | 0.035 (2) | 0.037 (3) | 0.062 (3) | 0.001 (2) | 0.014 (2) | 0.010 (2) |
| C30 | 0.030 (2) | 0.031 (2) | 0.049 (3) | −0.0040 (17) | 0.015 (2) | −0.0011 (19) |
| C31 | 0.049 (3) | 0.054 (3) | 0.059 (3) | 0.007 (3) | 0.015 (3) | 0.023 (3) |
| C32 | 0.062 (4) | 0.073 (4) | 0.039 (3) | 0.008 (3) | 0.010 (3) | 0.009 (3) |
| C33 | 0.055 (3) | 0.051 (3) | 0.037 (3) | 0.010 (2) | 0.013 (2) | 0.000 (2) |
| F1 | 0.123 (4) | 0.247 (7) | 0.102 (4) | −0.105 (5) | 0.056 (3) | −0.058 (4) |
| F2 | 0.114 (4) | 0.163 (5) | 0.174 (5) | −0.081 (4) | 0.116 (4) | −0.077 (4) |
| F3 | 0.0626 (18) | 0.0388 (15) | 0.0505 (16) | −0.0103 (13) | 0.0131 (14) | −0.0080 (13) |
| F4 | 0.176 (5) | 0.118 (4) | 0.0343 (18) | −0.005 (3) | 0.030 (2) | −0.014 (2) |
| F5 | 0.0458 (18) | 0.080 (2) | 0.076 (2) | 0.0011 (17) | 0.0149 (17) | 0.0107 (19) |
| F6 | 0.130 (4) | 0.150 (5) | 0.206 (6) | 0.017 (3) | 0.141 (4) | 0.043 (4) |
| N1 | 0.0321 (19) | 0.0286 (18) | 0.042 (2) | 0.0002 (15) | 0.0168 (16) | −0.0034 (16) |
| N2 | 0.038 (2) | 0.033 (2) | 0.0369 (19) | 0.0011 (16) | 0.0140 (16) | −0.0016 (16) |
| O1 | 0.053 (2) | 0.054 (2) | 0.0486 (19) | −0.0209 (17) | 0.0298 (17) | −0.0205 (16) |
| O2 | 0.0395 (18) | 0.0489 (19) | 0.0399 (17) | −0.0076 (15) | 0.0170 (15) | −0.0039 (15) |
| O3 | 0.0447 (18) | 0.0327 (16) | 0.0306 (15) | −0.0033 (13) | 0.0124 (13) | −0.0070 (12) |
| O4 | 0.057 (2) | 0.0307 (16) | 0.0282 (15) | −0.0037 (14) | 0.0100 (14) | −0.0012 (13) |
| O5 | 0.0467 (19) | 0.0359 (18) | 0.057 (2) | −0.0036 (14) | 0.0269 (17) | 0.0006 (15) |
| O6 | 0.0462 (19) | 0.049 (2) | 0.0405 (18) | 0.0153 (16) | 0.0155 (15) | 0.0000 (15) |
| Gd1—O3 | 2.332 (3) | C15—C16 | 1.509 (6) |
| Gd1—O4i | 2.391 (3) | C16—C21 | 1.382 (7) |
| Gd1—O6i | 2.397 (3) | C16—C17 | 1.388 (7) |
| Gd1—O5 | 2.429 (3) | C17—C18 | 1.391 (9) |
| Gd1—O1 | 2.465 (3) | C17—H17 | 0.930 |
| Gd1—O2 | 2.479 (3) | C18—C19 | 1.334 (11) |
| Gd1—N2 | 2.597 (4) | C18—H18 | 0.930 |
| Gd1—N1 | 2.627 (3) | C19—F6 | 1.359 (7) |
| Gd1—O6 | 2.921 (4) | C19—C20 | 1.372 (10) |
| C1—O2 | 1.257 (5) | C20—C21 | 1.381 (8) |
| C1—O1 | 1.267 (5) | C20—H20 | 0.930 |
| C1—C2 | 1.499 (6) | C21—F5 | 1.346 (6) |
| C2—C7 | 1.376 (7) | C22—N1 | 1.334 (6) |
| C2—C3 | 1.398 (7) | C22—C23 | 1.395 (7) |
| C3—C4 | 1.385 (7) | C22—H22 | 0.930 |
| C3—H3 | 0.930 | C23—C24 | 1.353 (8) |
| C4—C5 | 1.342 (9) | C23—H23 | 0.930 |
| C4—H4 | 0.930 | C24—C25 | 1.402 (7) |
| C5—C6 | 1.325 (10) | C24—H24 | 0.930 |
| C5—F2 | 1.355 (6) | C25—C26 | 1.416 (6) |
| C6—C7 | 1.383 (9) | C25—C27 | 1.431 (7) |
| C6—H6 | 0.930 | C26—N1 | 1.362 (6) |
| C7—F1 | 1.295 (7) | C26—C30 | 1.444 (7) |
| C8—O4 | 1.246 (5) | C27—C28 | 1.348 (8) |
| C8—O3 | 1.256 (5) | C27—H27 | 0.930 |
| C8—C9 | 1.507 (5) | C28—C29 | 1.426 (7) |
| C9—C14 | 1.390 (6) | C28—H28 | 0.930 |
| C9—C10 | 1.391 (6) | C29—C31 | 1.398 (8) |
| C10—C11 | 1.376 (6) | C29—C30 | 1.411 (6) |
| C10—H10 | 0.930 | C30—N2 | 1.358 (5) |
| C11—C12 | 1.360 (8) | C31—C32 | 1.375 (8) |
| C11—H11 | 0.930 | C31—H31 | 0.930 |
| C12—C13 | 1.364 (9) | C32—C33 | 1.390 (7) |
| C12—F4 | 1.364 (6) | C32—H32 | 0.930 |
| C13—C14 | 1.387 (7) | C33—N2 | 1.329 (6) |
| C13—H13 | 0.930 | C33—H33 | 0.930 |
| C14—F3 | 1.335 (6) | O4—Gd1i | 2.391 (3) |
| C15—O5 | 1.247 (5) | O6—Gd1i | 2.397 (3) |
| C15—O6 | 1.255 (5) | ||
| O3—Gd1—O4i | 130.13 (10) | F3—C14—C13 | 117.3 (4) |
| O3—Gd1—O6i | 73.87 (11) | F3—C14—C9 | 120.3 (4) |
| O4i—Gd1—O6i | 77.68 (10) | C13—C14—C9 | 122.4 (5) |
| O3—Gd1—O5 | 78.14 (11) | O5—C15—O6 | 123.2 (4) |
| O4i—Gd1—O5 | 85.99 (12) | O5—C15—C16 | 117.4 (4) |
| O6i—Gd1—O5 | 124.91 (11) | O6—C15—C16 | 119.3 (4) |
| O3—Gd1—O1 | 126.62 (10) | C21—C16—C17 | 117.4 (5) |
| O4i—Gd1—O1 | 89.20 (11) | C21—C16—C15 | 122.3 (4) |
| O6i—Gd1—O1 | 83.97 (12) | C17—C16—C15 | 119.9 (5) |
| O5—Gd1—O1 | 148.60 (11) | C16—C17—C18 | 120.6 (6) |
| O3—Gd1—O2 | 74.75 (10) | C16—C17—H17 | 119.7 |
| O4i—Gd1—O2 | 135.54 (11) | C18—C17—H17 | 119.7 |
| O6i—Gd1—O2 | 76.31 (11) | C19—C18—C17 | 119.5 (6) |
| O5—Gd1—O2 | 138.42 (11) | C19—C18—H18 | 120.3 |
| O1—Gd1—O2 | 52.79 (10) | C17—C18—H18 | 120.3 |
| O3—Gd1—N2 | 82.32 (11) | C18—C19—F6 | 120.7 (7) |
| O4i—Gd1—N2 | 138.85 (11) | C18—C19—C20 | 122.7 (6) |
| O6i—Gd1—N2 | 142.42 (11) | F6—C19—C20 | 116.5 (8) |
| O5—Gd1—N2 | 76.13 (11) | C19—C20—C21 | 117.4 (6) |
| O1—Gd1—N2 | 87.58 (12) | C19—C20—H20 | 121.3 |
| O2—Gd1—N2 | 69.53 (11) | C21—C20—H20 | 121.3 |
| O3—Gd1—N1 | 137.20 (11) | F5—C21—C20 | 117.7 (5) |
| O4i—Gd1—N1 | 76.43 (11) | F5—C21—C16 | 119.9 (5) |
| O6i—Gd1—N1 | 148.65 (11) | C20—C21—C16 | 122.4 (6) |
| O5—Gd1—N1 | 70.40 (11) | N1—C22—C23 | 123.1 (5) |
| O1—Gd1—N1 | 78.31 (11) | N1—C22—H22 | 118.4 |
| O2—Gd1—N1 | 111.36 (11) | C23—C22—H22 | 118.4 |
| N2—Gd1—N1 | 62.75 (11) | C24—C23—C22 | 119.8 (5) |
| O3—Gd1—O6 | 67.18 (9) | C24—C23—H23 | 120.1 |
| O4i—Gd1—O6 | 67.33 (10) | C22—C23—H23 | 120.1 |
| O6i—Gd1—O6 | 77.87 (11) | C23—C24—C25 | 119.9 (5) |
| O5—Gd1—O6 | 47.51 (10) | C23—C24—H24 | 120.1 |
| O1—Gd1—O6 | 152.79 (11) | C25—C24—H24 | 120.1 |
| O2—Gd1—O6 | 138.53 (10) | C24—C25—C26 | 116.9 (5) |
| N2—Gd1—O6 | 119.04 (10) | C24—C25—C27 | 123.2 (5) |
| N1—Gd1—O6 | 107.62 (10) | C26—C25—C27 | 119.8 (5) |
| O2—C1—O1 | 121.1 (4) | N1—C26—C25 | 123.1 (4) |
| O2—C1—C2 | 117.8 (4) | N1—C26—C30 | 118.1 (4) |
| O1—C1—C2 | 121.1 (4) | C25—C26—C30 | 118.8 (4) |
| C7—C2—C3 | 116.7 (5) | C28—C27—C25 | 121.0 (5) |
| C7—C2—C1 | 124.1 (4) | C28—C27—H27 | 119.5 |
| C3—C2—C1 | 119.1 (4) | C25—C27—H27 | 119.5 |
| C4—C3—C2 | 120.9 (5) | C27—C28—C29 | 121.0 (5) |
| C4—C3—H3 | 119.6 | C27—C28—H28 | 119.5 |
| C2—C3—H3 | 119.6 | C29—C28—H28 | 119.5 |
| C5—C4—C3 | 119.0 (5) | C31—C29—C30 | 117.6 (5) |
| C5—C4—H4 | 120.5 | C31—C29—C28 | 122.5 (5) |
| C3—C4—H4 | 120.5 | C30—C29—C28 | 119.9 (5) |
| C6—C5—C4 | 122.6 (6) | N2—C30—C29 | 122.7 (4) |
| C6—C5—F2 | 118.5 (6) | N2—C30—C26 | 117.8 (4) |
| C4—C5—F2 | 118.9 (6) | C29—C30—C26 | 119.4 (4) |
| C5—C6—C7 | 119.4 (6) | C32—C31—C29 | 119.7 (5) |
| C5—C6—H6 | 120.3 | C32—C31—H31 | 120.2 |
| C7—C6—H6 | 120.3 | C29—C31—H31 | 120.2 |
| F1—C7—C2 | 122.5 (5) | C31—C32—C33 | 118.6 (5) |
| F1—C7—C6 | 116.0 (6) | C31—C32—H32 | 120.7 |
| C2—C7—C6 | 121.4 (5) | C33—C32—H32 | 120.7 |
| O4—C8—O3 | 126.0 (4) | N2—C33—C32 | 124.1 (5) |
| O4—C8—C9 | 119.7 (4) | N2—C33—H33 | 117.9 |
| O3—C8—C9 | 114.2 (4) | C32—C33—H33 | 117.9 |
| C14—C9—C10 | 117.2 (4) | C22—N1—C26 | 117.1 (4) |
| C14—C9—C8 | 123.9 (4) | C22—N1—Gd1 | 122.8 (3) |
| C10—C9—C8 | 118.7 (4) | C26—N1—Gd1 | 119.9 (3) |
| C11—C10—C9 | 121.5 (5) | C33—N2—C30 | 117.3 (4) |
| C11—C10—H10 | 119.3 | C33—N2—Gd1 | 121.4 (3) |
| C9—C10—H10 | 119.3 | C30—N2—Gd1 | 121.3 (3) |
| C12—C11—C10 | 118.3 (5) | C1—O1—Gd1 | 93.1 (3) |
| C12—C11—H11 | 120.8 | C1—O2—Gd1 | 92.7 (3) |
| C10—C11—H11 | 120.8 | C8—O3—Gd1 | 139.2 (3) |
| C11—C12—C13 | 123.7 (5) | C8—O4—Gd1i | 136.2 (3) |
| C11—C12—F4 | 118.3 (6) | C15—O5—Gd1 | 106.2 (3) |
| C13—C12—F4 | 118.1 (6) | C15—O6—Gd1i | 174.2 (3) |
| C12—C13—C14 | 116.8 (5) | C15—O6—Gd1 | 82.5 (3) |
| C12—C13—H13 | 121.6 | Gd1i—O6—Gd1 | 102.13 (11) |
| C14—C13—H13 | 121.6 |