| Literature DB >> 21201353 |
Abstract
In the title complex, [CuTb(C(19)H(20)N(2)O(4))(NO(3))(3)]·CH(3)COCH(3), the Cu(II) atom is four-coordinated by two O atoms and two N atoms from the deprotonated Schiff base in a square-planar geometry, while the Tb(III) atom is ten-coordin-ated by four O atoms from the deprotonated Schiff base and six O atoms from three bidentate nitrate anions. The compound is isostructural with the previously reported Gd(III) analogue [Elmali & Elerman (2004 ▶). Z. Naturforsch. Teil B, 59, 535-540], which was described in the space group P1 with two formula units in the asymmetric unit. The crystal stucture is, in fact, centrosymmetric and is described here in the space group P with one formula unit in the asymmetric unit.Entities:
Year: 2008 PMID: 21201353 PMCID: PMC2960331 DOI: 10.1107/S1600536808002080
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [CuTb(C19H20N2O4)(NO3)3]·C3H6O | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 11368 reflections | |
| θ = 3.2–27.5º | |
| µ = 3.32 mm−1 | |
| α = 73.079 (16)º | |
| β = 86.67 (2)º | Block, green |
| γ = 72.33 (2)º | 0.19 × 0.16 × 0.14 mm |
| Rigaku R-AXIS RAPID diffractometer | 6275 independent reflections |
| Radiation source: fine-focus sealed tube | 5621 reflections with |
| Monochromator: graphite | |
| θmax = 27.5º | |
| ω scans | θmin = 3.1º |
| Absorption correction: multi-scan(ABSCOR; Higashi, 1995) | |
| 12171 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 = 0.049 | |
| 6275 reflections | Δρmax = 0.74 e Å−3 |
| 392 parameters | Δρmin = −0.50 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 |
| C1 | 0.5484 (3) | 0.7337 (3) | 0.4160 (3) | 0.0363 (7) | |
| C2 | 0.6382 (4) | 0.7732 (3) | 0.3361 (3) | 0.0355 (7) | |
| C3 | 0.7913 (4) | 0.7362 (3) | 0.3494 (3) | 0.0442 (8) | |
| H1 | 0.8502 | 0.7633 | 0.2961 | 0.053* | |
| C4 | 0.8589 (4) | 0.6565 (4) | 0.4446 (4) | 0.0527 (10) | |
| H2 | 0.9624 | 0.6320 | 0.4537 | 0.063* | |
| C5 | 0.7741 (4) | 0.6157 (3) | 0.5227 (3) | 0.0508 (10) | |
| H3 | 0.8202 | 0.5619 | 0.5842 | 0.061* | |
| C6 | 0.6164 (4) | 0.6543 (3) | 0.5113 (3) | 0.0421 (8) | |
| C7 | 0.5320 (4) | 0.6050 (3) | 0.5939 (3) | 0.0482 (9) | |
| H4 | 0.5879 | 0.5473 | 0.6503 | 0.058* | |
| C8 | 0.3378 (6) | 0.5605 (5) | 0.6968 (3) | 0.0765 (15) | |
| H5 | 0.3421 | 0.5970 | 0.7508 | 0.092* | |
| H6 | 0.4050 | 0.4785 | 0.7172 | 0.092* | |
| C9 | 0.1832 (6) | 0.5563 (4) | 0.6869 (4) | 0.0644 (12) | |
| H8 | 0.1638 | 0.4954 | 0.7459 | 0.077* | |
| H7 | 0.1742 | 0.5325 | 0.6259 | 0.077* | |
| C10 | 0.0688 (5) | 0.6752 (4) | 0.6798 (3) | 0.0515 (9) | |
| H9 | −0.0289 | 0.6632 | 0.6933 | 0.062* | |
| H10 | 0.0918 | 0.7081 | 0.7318 | 0.062* | |
| C11 | −0.0654 (4) | 0.8417 (3) | 0.5466 (3) | 0.0411 (7) | |
| H11 | −0.1404 | 0.8382 | 0.5941 | 0.049* | |
| C12 | −0.1088 (4) | 0.9332 (3) | 0.4497 (3) | 0.0381 (7) | |
| C13 | −0.2582 (4) | 1.0089 (4) | 0.4359 (3) | 0.0467 (8) | |
| H12 | −0.3229 | 1.0025 | 0.4903 | 0.056* | |
| C14 | −0.3085 (4) | 1.0922 (4) | 0.3422 (3) | 0.0517 (9) | |
| H13 | −0.4075 | 1.1409 | 0.3338 | 0.062* | |
| C15 | −0.2132 (4) | 1.1044 (3) | 0.2598 (3) | 0.0445 (8) | |
| H14 | −0.2484 | 1.1608 | 0.1968 | 0.053* | |
| C16 | −0.0665 (4) | 1.0325 (3) | 0.2724 (2) | 0.0350 (6) | |
| C17 | −0.0123 (3) | 0.9448 (3) | 0.3682 (2) | 0.0325 (6) | |
| C18 | −0.0137 (5) | 1.1106 (4) | 0.0937 (3) | 0.0528 (9) | |
| H15 | −0.0872 | 1.0826 | 0.0705 | 0.079* | |
| H16 | 0.0692 | 1.1047 | 0.0487 | 0.079* | |
| H17 | −0.0574 | 1.1934 | 0.0934 | 0.079* | |
| C19 | 0.6458 (5) | 0.8876 (4) | 0.1589 (3) | 0.0559 (10) | |
| H18 | 0.7078 | 0.9296 | 0.1766 | 0.084* | |
| H19 | 0.5788 | 0.9410 | 0.1026 | 0.084* | |
| H20 | 0.7076 | 0.8187 | 0.1393 | 0.084* | |
| C20 | 0.1948 (9) | 0.3899 (6) | −0.0076 (6) | 0.105 (2) | |
| H24 | 0.1539 | 0.4022 | −0.0743 | 0.158* | |
| H25 | 0.1212 | 0.3778 | 0.0431 | 0.158* | |
| H26 | 0.2814 | 0.3199 | 0.0078 | 0.158* | |
| C21 | 0.2373 (7) | 0.4967 (4) | −0.0065 (4) | 0.0723 (14) | |
| C22 | 0.3355 (8) | 0.4820 (5) | 0.0826 (5) | 0.0892 (17) | |
| H21 | 0.3467 | 0.5590 | 0.0801 | 0.134* | |
| H22 | 0.4319 | 0.4262 | 0.0789 | 0.134* | |
| H23 | 0.2906 | 0.4515 | 0.1459 | 0.134* | |
| Cu2 | 0.24442 (4) | 0.75725 (3) | 0.49586 (3) | 0.03510 (10) | |
| N1 | 0.3899 (4) | 0.6295 (3) | 0.6009 (2) | 0.0473 (7) | |
| N2 | 0.0640 (3) | 0.7635 (3) | 0.5764 (2) | 0.0388 (6) | |
| N3 | 0.3245 (4) | 1.1092 (3) | 0.2292 (3) | 0.0481 (7) | |
| N4 | 0.3809 (3) | 0.8115 (3) | 0.0469 (3) | 0.0479 (7) | |
| N5 | 0.1404 (4) | 0.6928 (3) | 0.2358 (3) | 0.0500 (7) | |
| O1 | 0.4010 (3) | 0.7715 (2) | 0.39786 (18) | 0.0432 (5) | |
| O2 | 0.5608 (3) | 0.8481 (2) | 0.24596 (19) | 0.0437 (5) | |
| O3 | 0.1291 (2) | 0.8745 (2) | 0.37547 (17) | 0.0392 (5) | |
| O4 | 0.0382 (3) | 1.0369 (2) | 0.19704 (18) | 0.0426 (5) | |
| O5 | 0.3132 (3) | 1.0309 (3) | 0.3128 (2) | 0.0533 (6) | |
| O6 | 0.3324 (4) | 1.2069 (3) | 0.2294 (3) | 0.0737 (10) | |
| O7 | 0.3240 (3) | 1.0788 (2) | 0.1473 (2) | 0.0492 (6) | |
| O8 | 0.3023 (3) | 0.9175 (2) | 0.0474 (2) | 0.0493 (6) | |
| O9 | 0.4110 (4) | 0.7857 (3) | −0.0338 (3) | 0.0720 (9) | |
| O10 | 0.4244 (3) | 0.7372 (2) | 0.1352 (2) | 0.0505 (6) | |
| O11 | 0.0991 (3) | 0.7990 (2) | 0.1769 (2) | 0.0533 (6) | |
| O12 | 0.0819 (4) | 0.6173 (3) | 0.2310 (3) | 0.0802 (11) | |
| O13 | 0.2473 (4) | 0.6682 (2) | 0.3006 (2) | 0.0574 (7) | |
| O14 | 0.2026 (6) | 0.5872 (4) | −0.0747 (3) | 0.1106 (16) | |
| Tb1 | 0.285531 (15) | 0.877969 (12) | 0.234617 (10) | 0.03350 (7) |
| C1 | 0.0339 (15) | 0.0339 (15) | 0.0403 (17) | −0.0059 (12) | −0.0049 (13) | −0.0129 (13) |
| C2 | 0.0362 (15) | 0.0292 (14) | 0.0398 (17) | −0.0085 (12) | −0.0044 (13) | −0.0084 (13) |
| C3 | 0.0336 (16) | 0.0386 (17) | 0.063 (2) | −0.0112 (13) | −0.0018 (15) | −0.0174 (17) |
| C4 | 0.0353 (17) | 0.051 (2) | 0.072 (3) | −0.0046 (15) | −0.0165 (18) | −0.024 (2) |
| C5 | 0.046 (2) | 0.0437 (19) | 0.055 (2) | 0.0031 (15) | −0.0219 (18) | −0.0149 (17) |
| C6 | 0.0411 (18) | 0.0354 (16) | 0.0444 (19) | 0.0003 (13) | −0.0121 (15) | −0.0131 (15) |
| C7 | 0.056 (2) | 0.0387 (18) | 0.0319 (17) | 0.0081 (15) | −0.0086 (16) | −0.0043 (14) |
| C8 | 0.077 (3) | 0.066 (3) | 0.040 (2) | 0.009 (2) | 0.010 (2) | 0.022 (2) |
| C9 | 0.105 (4) | 0.0377 (19) | 0.048 (2) | −0.027 (2) | 0.012 (2) | −0.0054 (17) |
| C10 | 0.057 (2) | 0.060 (2) | 0.0343 (18) | −0.0255 (19) | 0.0065 (16) | −0.0008 (17) |
| C11 | 0.0421 (17) | 0.0494 (19) | 0.0397 (18) | −0.0193 (15) | 0.0100 (14) | −0.0205 (16) |
| C12 | 0.0357 (16) | 0.0404 (16) | 0.0441 (18) | −0.0139 (13) | 0.0031 (13) | −0.0187 (15) |
| C13 | 0.0377 (17) | 0.057 (2) | 0.053 (2) | −0.0160 (16) | 0.0086 (15) | −0.0263 (18) |
| C14 | 0.0327 (17) | 0.057 (2) | 0.065 (2) | 0.0007 (15) | −0.0070 (17) | −0.029 (2) |
| C15 | 0.0382 (17) | 0.0423 (18) | 0.051 (2) | −0.0019 (14) | −0.0113 (15) | −0.0180 (16) |
| C16 | 0.0363 (15) | 0.0312 (14) | 0.0363 (16) | −0.0056 (12) | −0.0046 (13) | −0.0118 (13) |
| C17 | 0.0304 (14) | 0.0309 (14) | 0.0371 (16) | −0.0090 (11) | −0.0020 (12) | −0.0107 (13) |
| C18 | 0.056 (2) | 0.047 (2) | 0.0378 (19) | 0.0001 (17) | −0.0110 (17) | 0.0009 (16) |
| C19 | 0.047 (2) | 0.065 (2) | 0.052 (2) | −0.0237 (19) | 0.0100 (17) | −0.006 (2) |
| C20 | 0.127 (6) | 0.070 (4) | 0.099 (5) | −0.021 (4) | −0.041 (4) | 0.004 (3) |
| C21 | 0.093 (4) | 0.049 (2) | 0.056 (3) | −0.006 (2) | 0.018 (3) | −0.008 (2) |
| C22 | 0.124 (5) | 0.057 (3) | 0.080 (4) | −0.021 (3) | 0.001 (4) | −0.017 (3) |
| Cu2 | 0.0369 (2) | 0.03297 (19) | 0.02827 (19) | −0.00746 (16) | 0.00002 (15) | −0.00112 (16) |
| N1 | 0.0553 (18) | 0.0390 (15) | 0.0307 (14) | 0.0011 (13) | 0.0008 (13) | −0.0005 (12) |
| N2 | 0.0462 (15) | 0.0427 (15) | 0.0307 (14) | −0.0200 (13) | 0.0034 (12) | −0.0085 (12) |
| N3 | 0.0469 (17) | 0.0448 (17) | 0.0512 (19) | −0.0138 (14) | −0.0015 (14) | −0.0113 (15) |
| N4 | 0.0419 (16) | 0.0621 (19) | 0.0450 (17) | −0.0191 (15) | 0.0063 (13) | −0.0205 (16) |
| N5 | 0.0483 (17) | 0.0406 (16) | 0.060 (2) | −0.0183 (14) | 0.0202 (15) | −0.0117 (15) |
| O1 | 0.0304 (11) | 0.0507 (14) | 0.0324 (11) | −0.0035 (10) | −0.0023 (9) | 0.0036 (10) |
| O2 | 0.0343 (12) | 0.0521 (14) | 0.0374 (13) | −0.0126 (11) | 0.0025 (10) | −0.0025 (11) |
| O3 | 0.0319 (11) | 0.0414 (12) | 0.0307 (11) | −0.0015 (9) | 0.0007 (9) | 0.0001 (10) |
| O4 | 0.0387 (12) | 0.0368 (12) | 0.0369 (12) | 0.0031 (10) | −0.0076 (10) | −0.0011 (10) |
| O5 | 0.0615 (17) | 0.0517 (15) | 0.0443 (14) | −0.0160 (13) | 0.0051 (12) | −0.0118 (13) |
| O6 | 0.095 (3) | 0.0440 (16) | 0.084 (2) | −0.0250 (16) | −0.011 (2) | −0.0140 (16) |
| O7 | 0.0602 (16) | 0.0467 (14) | 0.0375 (13) | −0.0200 (12) | 0.0008 (12) | −0.0030 (11) |
| O8 | 0.0596 (16) | 0.0458 (14) | 0.0369 (13) | −0.0136 (12) | 0.0043 (11) | −0.0065 (11) |
| O9 | 0.075 (2) | 0.093 (2) | 0.0543 (18) | −0.0167 (18) | 0.0059 (16) | −0.0401 (18) |
| O10 | 0.0519 (15) | 0.0448 (14) | 0.0441 (14) | −0.0038 (11) | −0.0027 (12) | −0.0073 (12) |
| O11 | 0.0455 (14) | 0.0491 (15) | 0.0627 (17) | −0.0158 (12) | 0.0011 (13) | −0.0104 (13) |
| O12 | 0.079 (2) | 0.070 (2) | 0.115 (3) | −0.0458 (19) | 0.034 (2) | −0.042 (2) |
| O13 | 0.0661 (18) | 0.0377 (13) | 0.0569 (17) | −0.0112 (13) | 0.0044 (14) | −0.0016 (12) |
| O14 | 0.157 (5) | 0.065 (2) | 0.077 (3) | −0.011 (3) | 0.008 (3) | 0.004 (2) |
| Tb1 | 0.03237 (9) | 0.03267 (9) | 0.02717 (9) | −0.00535 (6) | −0.00082 (6) | −0.00045 (6) |
| C1—O1 | 1.332 (4) | C18—H16 | 0.960 |
| C1—C2 | 1.399 (5) | C18—H17 | 0.960 |
| C1—C6 | 1.418 (5) | C19—O2 | 1.435 (5) |
| C2—C3 | 1.375 (4) | C19—H18 | 0.960 |
| C2—O2 | 1.382 (4) | C19—H19 | 0.960 |
| C3—C4 | 1.417 (6) | C19—H20 | 0.960 |
| C3—H1 | 0.930 | C20—C21 | 1.469 (8) |
| C4—C5 | 1.357 (6) | C20—H24 | 0.960 |
| C4—H2 | 0.930 | C20—H25 | 0.960 |
| C5—C6 | 1.414 (5) | C20—H26 | 0.960 |
| C5—H3 | 0.930 | C21—O14 | 1.181 (6) |
| C6—C7 | 1.428 (6) | C21—C22 | 1.502 (8) |
| C7—N1 | 1.279 (5) | C22—H21 | 0.960 |
| C7—H4 | 0.930 | C22—H22 | 0.960 |
| C8—N1 | 1.476 (5) | C22—H23 | 0.960 |
| C8—C9 | 1.483 (8) | Cu2—O1 | 1.939 (3) |
| C8—H5 | 0.970 | Cu2—O3 | 1.947 (2) |
| C8—H6 | 0.970 | Cu2—N2 | 1.957 (3) |
| C9—C10 | 1.493 (6) | Cu2—N1 | 1.989 (3) |
| C9—H8 | 0.970 | Cu2—Tb1 | 3.4749 (16) |
| C9—H7 | 0.970 | N3—O6 | 1.208 (4) |
| C10—N2 | 1.492 (5) | N3—O7 | 1.271 (4) |
| C10—H9 | 0.970 | N3—O5 | 1.274 (4) |
| C10—H10 | 0.970 | N4—O9 | 1.222 (4) |
| C11—N2 | 1.293 (5) | N4—O8 | 1.274 (4) |
| C11—C12 | 1.439 (5) | N4—O10 | 1.275 (4) |
| C11—H11 | 0.930 | N5—O12 | 1.219 (4) |
| C12—C17 | 1.394 (5) | N5—O11 | 1.257 (4) |
| C12—C13 | 1.411 (5) | N5—O13 | 1.280 (5) |
| C13—C14 | 1.377 (6) | O1—Tb1 | 2.352 (2) |
| C13—H12 | 0.930 | O2—Tb1 | 2.506 (3) |
| C14—C15 | 1.396 (6) | O3—Tb1 | 2.344 (3) |
| C14—H13 | 0.930 | O4—Tb1 | 2.492 (2) |
| C15—C16 | 1.377 (5) | O5—Tb1 | 2.470 (3) |
| C15—H14 | 0.930 | O7—Tb1 | 2.501 (3) |
| C16—O4 | 1.379 (4) | O8—Tb1 | 2.455 (3) |
| C16—C17 | 1.424 (4) | O10—Tb1 | 2.494 (3) |
| C17—O3 | 1.333 (4) | O11—Tb1 | 2.491 (3) |
| C18—O4 | 1.448 (4) | O13—Tb1 | 2.564 (3) |
| C18—H15 | 0.960 | ||
| O1—C1—C2 | 117.8 (3) | O1—Cu2—Tb1 | 40.14 (7) |
| O1—C1—C6 | 122.7 (3) | O3—Cu2—Tb1 | 39.95 (7) |
| C2—C1—C6 | 119.5 (3) | N2—Cu2—Tb1 | 130.52 (9) |
| C3—C2—O2 | 124.7 (3) | N1—Cu2—Tb1 | 129.85 (10) |
| C3—C2—C1 | 120.6 (3) | C7—N1—C8 | 115.4 (3) |
| O2—C2—C1 | 114.7 (3) | C7—N1—Cu2 | 123.8 (3) |
| C2—C3—C4 | 119.8 (4) | C8—N1—Cu2 | 120.7 (3) |
| C2—C3—H1 | 120.1 | C11—N2—C10 | 115.0 (3) |
| C4—C3—H1 | 120.1 | C11—N2—Cu2 | 124.3 (2) |
| C5—C4—C3 | 120.7 (3) | C10—N2—Cu2 | 120.7 (2) |
| C5—C4—H2 | 119.7 | O6—N3—O7 | 123.1 (4) |
| C3—C4—H2 | 119.7 | O6—N3—O5 | 120.8 (4) |
| C4—C5—C6 | 120.5 (3) | O7—N3—O5 | 116.1 (3) |
| C4—C5—H3 | 119.7 | O9—N4—O8 | 121.0 (4) |
| C6—C5—H3 | 119.7 | O9—N4—O10 | 123.8 (4) |
| C5—C6—C1 | 118.9 (4) | O8—N4—O10 | 115.2 (3) |
| C5—C6—C7 | 118.6 (3) | O12—N5—O11 | 121.5 (4) |
| C1—C6—C7 | 122.3 (3) | O12—N5—O13 | 122.0 (4) |
| N1—C7—C6 | 128.9 (3) | O11—N5—O13 | 116.5 (3) |
| N1—C7—H4 | 115.6 | C1—O1—Cu2 | 128.2 (2) |
| C6—C7—H4 | 115.6 | C1—O1—Tb1 | 124.0 (2) |
| N1—C8—C9 | 113.1 (4) | Cu2—O1—Tb1 | 107.76 (10) |
| N1—C8—H5 | 109.0 | C2—O2—C19 | 118.0 (3) |
| C9—C8—H5 | 109.0 | C2—O2—Tb1 | 118.0 (2) |
| N1—C8—H6 | 109.0 | C19—O2—Tb1 | 123.2 (2) |
| C9—C8—H6 | 109.0 | C17—O3—Cu2 | 129.3 (2) |
| H5—C8—H6 | 107.8 | C17—O3—Tb1 | 122.90 (19) |
| C8—C9—C10 | 112.3 (4) | Cu2—O3—Tb1 | 107.83 (10) |
| C8—C9—H8 | 109.1 | C16—O4—C18 | 117.7 (3) |
| C10—C9—H8 | 109.1 | C16—O4—Tb1 | 117.60 (18) |
| C8—C9—H7 | 109.1 | C18—O4—Tb1 | 122.5 (2) |
| C10—C9—H7 | 109.1 | N3—O5—Tb1 | 96.8 (2) |
| H8—C9—H7 | 107.9 | N3—O7—Tb1 | 95.4 (2) |
| N2—C10—C9 | 111.7 (3) | N4—O8—Tb1 | 97.5 (2) |
| N2—C10—H9 | 109.3 | N4—O10—Tb1 | 95.6 (2) |
| C9—C10—H9 | 109.3 | N5—O11—Tb1 | 98.5 (2) |
| N2—C10—H10 | 109.3 | N5—O13—Tb1 | 94.4 (2) |
| C9—C10—H10 | 109.3 | O3—Tb1—O1 | 63.45 (9) |
| H9—C10—H10 | 107.9 | O3—Tb1—O8 | 146.77 (9) |
| N2—C11—C12 | 128.6 (3) | O1—Tb1—O8 | 147.69 (9) |
| N2—C11—H11 | 115.7 | O3—Tb1—O5 | 72.83 (9) |
| C12—C11—H11 | 115.7 | O1—Tb1—O5 | 73.37 (10) |
| C17—C12—C13 | 119.4 (3) | O8—Tb1—O5 | 118.67 (9) |
| C17—C12—C11 | 122.6 (3) | O3—Tb1—O11 | 81.12 (10) |
| C13—C12—C11 | 117.9 (3) | O1—Tb1—O11 | 116.73 (9) |
| C14—C13—C12 | 120.2 (4) | O8—Tb1—O11 | 72.71 (10) |
| C14—C13—H12 | 119.9 | O5—Tb1—O11 | 143.71 (10) |
| C12—C13—H12 | 119.9 | O3—Tb1—O4 | 65.89 (8) |
| C13—C14—C15 | 121.0 (3) | O1—Tb1—O4 | 126.51 (9) |
| C13—C14—H13 | 119.5 | O8—Tb1—O4 | 85.75 (9) |
| C15—C14—H13 | 119.5 | O5—Tb1—O4 | 76.54 (9) |
| C16—C15—C14 | 119.5 (3) | O11—Tb1—O4 | 69.87 (9) |
| C16—C15—H14 | 120.2 | O3—Tb1—O10 | 138.29 (9) |
| C14—C15—H14 | 120.2 | O1—Tb1—O10 | 99.56 (9) |
| C15—C16—O4 | 124.8 (3) | O8—Tb1—O10 | 51.53 (9) |
| C15—C16—C17 | 120.5 (3) | O5—Tb1—O10 | 142.00 (10) |
| O4—C16—C17 | 114.6 (3) | O11—Tb1—O10 | 73.34 (10) |
| O3—C17—C12 | 122.4 (3) | O4—Tb1—O10 | 130.23 (8) |
| O3—C17—C16 | 118.3 (3) | O3—Tb1—O7 | 115.07 (9) |
| C12—C17—C16 | 119.3 (3) | O1—Tb1—O7 | 117.69 (9) |
| O4—C18—H15 | 109.5 | O8—Tb1—O7 | 67.18 (9) |
| O4—C18—H16 | 109.5 | O5—Tb1—O7 | 51.50 (9) |
| H15—C18—H16 | 109.5 | O11—Tb1—O7 | 124.64 (9) |
| O4—C18—H17 | 109.5 | O4—Tb1—O7 | 70.61 (10) |
| H15—C18—H17 | 109.5 | O10—Tb1—O7 | 106.57 (10) |
| H16—C18—H17 | 109.5 | O3—Tb1—O2 | 124.00 (8) |
| O2—C19—H18 | 109.5 | O1—Tb1—O2 | 64.58 (8) |
| O2—C19—H19 | 109.5 | O8—Tb1—O2 | 89.00 (9) |
| H18—C19—H19 | 109.5 | O5—Tb1—O2 | 73.82 (9) |
| O2—C19—H20 | 109.5 | O11—Tb1—O2 | 142.46 (9) |
| H18—C19—H20 | 109.5 | O4—Tb1—O2 | 142.70 (9) |
| H19—C19—H20 | 109.5 | O10—Tb1—O2 | 69.68 (9) |
| C21—C20—H24 | 109.5 | O7—Tb1—O2 | 73.33 (9) |
| C21—C20—H25 | 109.5 | O3—Tb1—O13 | 71.12 (10) |
| H24—C20—H25 | 109.5 | O1—Tb1—O13 | 68.46 (10) |
| C21—C20—H26 | 109.5 | O8—Tb1—O13 | 105.29 (10) |
| H24—C20—H26 | 109.5 | O5—Tb1—O13 | 136.01 (10) |
| H25—C20—H26 | 109.5 | O11—Tb1—O13 | 50.51 (10) |
| O14—C21—C20 | 121.7 (6) | O4—Tb1—O13 | 109.79 (10) |
| O14—C21—C22 | 121.8 (5) | O10—Tb1—O13 | 67.18 (10) |
| C20—C21—C22 | 116.4 (5) | O7—Tb1—O13 | 172.48 (9) |
| C21—C22—H21 | 109.5 | O2—Tb1—O13 | 107.22 (10) |
| C21—C22—H22 | 109.5 | O3—Tb1—Cu2 | 32.23 (5) |
| H21—C22—H22 | 109.5 | O1—Tb1—Cu2 | 32.10 (6) |
| C21—C22—H23 | 109.5 | O8—Tb1—Cu2 | 165.72 (6) |
| H21—C22—H23 | 109.5 | O5—Tb1—Cu2 | 75.60 (7) |
| H22—C22—H23 | 109.5 | O11—Tb1—Cu2 | 95.49 (8) |
| O1—Cu2—O3 | 78.92 (10) | O4—Tb1—Cu2 | 97.89 (6) |
| O1—Cu2—N2 | 170.42 (11) | O10—Tb1—Cu2 | 118.11 (7) |
| O3—Cu2—N2 | 91.51 (12) | O7—Tb1—Cu2 | 127.06 (6) |
| O1—Cu2—N1 | 91.40 (12) | O2—Tb1—Cu2 | 96.16 (6) |
| O3—Cu2—N1 | 169.69 (12) | O13—Tb1—Cu2 | 60.46 (7) |
| N2—Cu2—N1 | 98.17 (13) |
Selected bond lengths (Å)
| Cu2—O1 | 1.939 (3) |
| Cu2—O3 | 1.947 (2) |
| Cu2—N2 | 1.957 (3) |
| Cu2—N1 | 1.989 (3) |
| O1—Tb1 | 2.352 (2) |
| O2—Tb1 | 2.506 (3) |
| O3—Tb1 | 2.344 (3) |
| O4—Tb1 | 2.492 (2) |
| O5—Tb1 | 2.470 (3) |
| O7—Tb1 | 2.501 (3) |
| O8—Tb1 | 2.455 (3) |
| O10—Tb1 | 2.494 (3) |
| O11—Tb1 | 2.491 (3) |
| O13—Tb1 | 2.564 (3) |