| Literature DB >> 24454160 |
Avijit Pramanik1, Frank R Fronczek2, Ramaiyer Venkatraman1, Md Alamgir Hossain1.
Abstract
In the centrosymmetric trinuclear Zn(II)⋯Ca(II)⋯Zn(II) title complex, [CaZn2(CH3COO)6(C12H12N2)2], the Ca(II) ion lies on an inversion centre and is octa-hedrally coordinated by six acetate O atoms. The Zn(II) ion is coordinated by two N atoms from a bidentate di-methyl-bipyridine ligand and three O atoms from acetate ligands bridging to the Ca(II) ion, leading to a distorted square-pyramidal coordination sphere. The Zn⋯Ca distance is 3.4668 (5) Å.Entities:
Year: 2013 PMID: 24454160 PMCID: PMC3884985 DOI: 10.1107/S1600536813030122
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [CaZn2(C2H3O2)6(C12H12N2)2] | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 7990 reflections | |
| θ = 2.5–36.7° | |
| µ = 1.45 mm−1 | |
| α = 74.103 (7)° | |
| β = 83.263 (6)° | Parallelepiped, colorless |
| γ = 83.560 (7)° | 0.34 × 0.32 × 0.27 mm |
| Nonius KappaCCD diffractometer | 8962 independent reflections |
| Radiation source: fine-focus sealed tube | 7497 reflections with |
| Graphite monochromator | |
| ω and φ scans | θmax = 36.7°, θmin = 3.0° |
| Absorption correction: multi-scan ( | |
| 16096 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 = 0.001 | |
| 8962 reflections | Δρmax = 0.65 e Å−3 |
| 256 parameters | Δρmin = −0.78 e Å−3 |
| 0 restraints | Extinction correction: |
| Primary atom site location: structure-invariant direct methods | Extinction coefficient: 0.0061 (13) |
| 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 |
| Zn1 | 0.645512 (17) | 0.565205 (16) | 0.245482 (10) | 0.01344 (4) | |
| Ca1 | 0.5000 | 0.5000 | 0.5000 | 0.01472 (6) | |
| O1 | 0.42917 (11) | 0.57148 (11) | 0.33397 (7) | 0.01780 (16) | |
| O2 | 0.36225 (13) | 0.71366 (13) | 0.18192 (8) | 0.02391 (19) | |
| O3 | 0.83825 (11) | 0.42210 (11) | 0.30301 (7) | 0.01864 (16) | |
| O4 | 0.69345 (13) | 0.32456 (12) | 0.45013 (8) | 0.02265 (18) | |
| O5 | 0.71692 (12) | 0.76819 (11) | 0.26269 (7) | 0.01935 (17) | |
| O6 | 0.68069 (13) | 0.68704 (12) | 0.43296 (7) | 0.02151 (18) | |
| N1 | 0.73039 (13) | 0.60239 (13) | 0.09209 (8) | 0.01657 (18) | |
| N2 | 0.56062 (13) | 0.37004 (12) | 0.20333 (8) | 0.01583 (17) | |
| C1 | 0.81557 (16) | 0.72407 (16) | 0.04117 (10) | 0.0197 (2) | |
| H1 | 0.8270 | 0.8035 | 0.0740 | 0.024* | |
| C2 | 0.88835 (16) | 0.73989 (19) | −0.05764 (10) | 0.0240 (3) | |
| C3 | 0.87138 (17) | 0.62079 (19) | −0.10347 (10) | 0.0252 (3) | |
| H3 | 0.9215 | 0.6255 | −0.1701 | 0.030* | |
| C4 | 0.78117 (17) | 0.49493 (18) | −0.05182 (10) | 0.0222 (2) | |
| H4 | 0.7676 | 0.4143 | −0.0832 | 0.027* | |
| C5 | 0.71088 (15) | 0.48875 (15) | 0.04678 (9) | 0.0172 (2) | |
| C6 | 0.61311 (15) | 0.35900 (15) | 0.10892 (9) | 0.0169 (2) | |
| C7 | 0.57756 (16) | 0.23203 (17) | 0.07454 (11) | 0.0218 (2) | |
| H7 | 0.6131 | 0.2261 | 0.0071 | 0.026* | |
| C8 | 0.48959 (17) | 0.11521 (16) | 0.14069 (12) | 0.0232 (3) | |
| H8 | 0.4667 | 0.0273 | 0.1189 | 0.028* | |
| C9 | 0.43442 (15) | 0.12613 (15) | 0.23931 (11) | 0.0196 (2) | |
| C10 | 0.47342 (15) | 0.25801 (14) | 0.26603 (10) | 0.0176 (2) | |
| H10 | 0.4362 | 0.2690 | 0.3322 | 0.021* | |
| C11 | 0.9812 (2) | 0.8811 (2) | −0.11066 (13) | 0.0346 (4) | |
| H11A | 1.0352 | 0.8670 | −0.1755 | 0.052* | |
| H11B | 1.0625 | 0.8915 | −0.0673 | 0.052* | |
| H11C | 0.9061 | 0.9765 | −0.1237 | 0.052* | |
| C12 | 0.34091 (18) | 0.00266 (16) | 0.31539 (13) | 0.0256 (3) | |
| H12A | 0.3132 | 0.0348 | 0.3787 | 0.038* | |
| H12B | 0.4074 | −0.0983 | 0.3295 | 0.038* | |
| H12C | 0.2413 | −0.0090 | 0.2876 | 0.038* | |
| C13 | 0.32312 (15) | 0.64702 (15) | 0.27164 (10) | 0.0181 (2) | |
| C14 | 0.14820 (17) | 0.6467 (2) | 0.31439 (13) | 0.0278 (3) | |
| H14A | 0.0848 | 0.7359 | 0.2725 | 0.042* | |
| H14B | 0.1400 | 0.6562 | 0.3845 | 0.042* | |
| H14C | 0.1060 | 0.5478 | 0.3141 | 0.042* | |
| C15 | 0.82225 (15) | 0.33229 (14) | 0.39256 (10) | 0.0172 (2) | |
| C16 | 0.97115 (18) | 0.22946 (17) | 0.43100 (12) | 0.0258 (3) | |
| H16A | 1.0392 | 0.2906 | 0.4569 | 0.039* | |
| H16B | 1.0326 | 0.1928 | 0.3751 | 0.039* | |
| H16C | 0.9382 | 0.1383 | 0.4860 | 0.039* | |
| C17 | 0.71988 (15) | 0.78611 (14) | 0.35138 (10) | 0.0168 (2) | |
| C18 | 0.77759 (17) | 0.93922 (15) | 0.35734 (11) | 0.0211 (2) | |
| H18A | 0.7256 | 0.9663 | 0.4190 | 0.032* | |
| H18B | 0.7491 | 1.0235 | 0.2972 | 0.032* | |
| H18C | 0.8955 | 0.9271 | 0.3597 | 0.032* |
| Zn1 | 0.01502 (6) | 0.01454 (7) | 0.01144 (6) | −0.00042 (4) | −0.00181 (4) | −0.00464 (4) |
| Ca1 | 0.01700 (14) | 0.01496 (13) | 0.01184 (13) | −0.00157 (10) | −0.00028 (10) | −0.00328 (10) |
| O1 | 0.0157 (4) | 0.0207 (4) | 0.0197 (4) | 0.0005 (3) | −0.0035 (3) | −0.0098 (3) |
| O2 | 0.0267 (5) | 0.0276 (5) | 0.0201 (4) | −0.0007 (4) | −0.0052 (4) | −0.0103 (4) |
| O3 | 0.0182 (4) | 0.0205 (4) | 0.0170 (4) | 0.0008 (3) | −0.0045 (3) | −0.0043 (3) |
| O4 | 0.0236 (4) | 0.0183 (4) | 0.0232 (5) | −0.0002 (3) | 0.0002 (4) | −0.0024 (3) |
| O5 | 0.0234 (4) | 0.0193 (4) | 0.0172 (4) | −0.0026 (3) | −0.0031 (3) | −0.0072 (3) |
| O6 | 0.0267 (5) | 0.0201 (4) | 0.0180 (4) | −0.0057 (3) | −0.0054 (3) | −0.0026 (3) |
| N1 | 0.0152 (4) | 0.0210 (5) | 0.0138 (4) | 0.0009 (3) | −0.0031 (3) | −0.0053 (3) |
| N2 | 0.0169 (4) | 0.0158 (4) | 0.0168 (4) | 0.0015 (3) | −0.0045 (3) | −0.0076 (3) |
| C1 | 0.0180 (5) | 0.0246 (6) | 0.0152 (5) | −0.0017 (4) | −0.0014 (4) | −0.0032 (4) |
| C2 | 0.0177 (5) | 0.0345 (7) | 0.0161 (5) | 0.0009 (5) | −0.0013 (4) | −0.0017 (5) |
| C3 | 0.0210 (6) | 0.0391 (8) | 0.0132 (5) | 0.0048 (5) | −0.0015 (4) | −0.0058 (5) |
| C4 | 0.0209 (5) | 0.0320 (7) | 0.0149 (5) | 0.0056 (5) | −0.0042 (4) | −0.0104 (5) |
| C5 | 0.0159 (5) | 0.0235 (5) | 0.0137 (5) | 0.0044 (4) | −0.0050 (4) | −0.0080 (4) |
| C6 | 0.0154 (5) | 0.0209 (5) | 0.0166 (5) | 0.0041 (4) | −0.0061 (4) | −0.0091 (4) |
| C7 | 0.0212 (6) | 0.0259 (6) | 0.0234 (6) | 0.0042 (5) | −0.0075 (5) | −0.0152 (5) |
| C8 | 0.0211 (6) | 0.0225 (6) | 0.0322 (7) | 0.0032 (4) | −0.0095 (5) | −0.0166 (5) |
| C9 | 0.0166 (5) | 0.0166 (5) | 0.0281 (6) | 0.0024 (4) | −0.0072 (4) | −0.0097 (4) |
| C10 | 0.0171 (5) | 0.0166 (5) | 0.0211 (5) | 0.0007 (4) | −0.0039 (4) | −0.0081 (4) |
| C11 | 0.0299 (7) | 0.0446 (9) | 0.0227 (7) | −0.0096 (7) | 0.0040 (6) | 0.0022 (6) |
| C12 | 0.0218 (6) | 0.0177 (5) | 0.0392 (8) | −0.0020 (4) | −0.0039 (5) | −0.0102 (5) |
| C13 | 0.0159 (5) | 0.0188 (5) | 0.0241 (6) | −0.0008 (4) | −0.0039 (4) | −0.0129 (4) |
| C14 | 0.0143 (5) | 0.0355 (7) | 0.0371 (8) | −0.0019 (5) | −0.0008 (5) | −0.0160 (6) |
| C15 | 0.0204 (5) | 0.0133 (5) | 0.0189 (5) | 0.0013 (4) | −0.0063 (4) | −0.0053 (4) |
| C16 | 0.0263 (6) | 0.0225 (6) | 0.0279 (7) | 0.0090 (5) | −0.0108 (5) | −0.0066 (5) |
| C17 | 0.0168 (5) | 0.0155 (5) | 0.0195 (5) | 0.0000 (4) | −0.0049 (4) | −0.0063 (4) |
| C18 | 0.0259 (6) | 0.0165 (5) | 0.0234 (6) | −0.0039 (4) | −0.0062 (5) | −0.0067 (4) |
| Zn1—O3 | 2.0243 (10) | C4—C5 | 1.3968 (18) |
| Zn1—O5 | 2.0334 (10) | C4—H4 | 0.9500 |
| Zn1—O1 | 2.0556 (10) | C5—C6 | 1.4887 (19) |
| Zn1—N1 | 2.0851 (11) | C6—C7 | 1.4023 (18) |
| Zn1—N2 | 2.1741 (10) | C7—C8 | 1.388 (2) |
| Zn1—Ca1 | 3.4668 (5) | C7—H7 | 0.9500 |
| Ca1—O4i | 2.2876 (10) | C8—C9 | 1.400 (2) |
| Ca1—O4 | 2.2876 (10) | C8—H8 | 0.9500 |
| Ca1—O6i | 2.2910 (10) | C9—C10 | 1.3949 (17) |
| Ca1—O6 | 2.2910 (10) | C9—C12 | 1.504 (2) |
| Ca1—O1 | 2.3158 (10) | C10—H10 | 0.9500 |
| Ca1—O1i | 2.3158 (10) | C11—H11A | 0.9800 |
| Ca1—Zn1i | 3.4668 (5) | C11—H11B | 0.9800 |
| O1—C13 | 1.2994 (16) | C11—H11C | 0.9800 |
| O2—C13 | 1.2313 (17) | C12—H12A | 0.9800 |
| O3—C15 | 1.2666 (15) | C12—H12B | 0.9800 |
| O4—C15 | 1.2520 (17) | C12—H12C | 0.9800 |
| O5—C17 | 1.2706 (15) | C13—C14 | 1.5061 (19) |
| O6—C17 | 1.2509 (16) | C14—H14A | 0.9800 |
| N1—C1 | 1.3386 (17) | C14—H14B | 0.9800 |
| N1—C5 | 1.3502 (16) | C14—H14C | 0.9800 |
| N2—C10 | 1.3401 (17) | C15—C16 | 1.5106 (18) |
| N2—C6 | 1.3415 (16) | C16—H16A | 0.9800 |
| C1—C2 | 1.3935 (19) | C16—H16B | 0.9800 |
| C1—H1 | 0.9500 | C16—H16C | 0.9800 |
| C2—C3 | 1.393 (2) | C17—C18 | 1.5121 (17) |
| C2—C11 | 1.507 (2) | C18—H18A | 0.9800 |
| C3—C4 | 1.391 (2) | C18—H18B | 0.9800 |
| C3—H3 | 0.9500 | C18—H18C | 0.9800 |
| O3—Zn1—O5 | 96.76 (4) | N2—C6—C5 | 114.92 (10) |
| O3—Zn1—O1 | 120.20 (4) | C7—C6—C5 | 124.11 (11) |
| O5—Zn1—O1 | 95.68 (4) | C8—C7—C6 | 118.89 (12) |
| O3—Zn1—N1 | 96.90 (4) | C8—C7—H7 | 120.6 |
| O5—Zn1—N1 | 96.21 (4) | C6—C7—H7 | 120.6 |
| O1—Zn1—N1 | 139.18 (4) | C7—C8—C9 | 120.39 (12) |
| O3—Zn1—N2 | 89.55 (4) | C7—C8—H8 | 119.8 |
| O5—Zn1—N2 | 171.01 (4) | C9—C8—H8 | 119.8 |
| O1—Zn1—N2 | 86.60 (4) | C10—C9—C8 | 116.57 (13) |
| N1—Zn1—N2 | 76.62 (4) | C10—C9—C12 | 120.25 (13) |
| O4i—Ca1—O4 | 180.0 | C8—C9—C12 | 123.17 (12) |
| O4i—Ca1—O6i | 86.56 (4) | N2—C10—C9 | 123.49 (12) |
| O4—Ca1—O6i | 93.44 (4) | N2—C10—H10 | 118.3 |
| O4i—Ca1—O6 | 93.44 (4) | C9—C10—H10 | 118.3 |
| O4—Ca1—O6 | 86.56 (4) | C2—C11—H11A | 109.5 |
| O6i—Ca1—O6 | 180.0 | C2—C11—H11B | 109.5 |
| O4i—Ca1—O1 | 93.28 (4) | H11A—C11—H11B | 109.5 |
| O4—Ca1—O1 | 86.72 (4) | C2—C11—H11C | 109.5 |
| O6i—Ca1—O1 | 97.73 (3) | H11A—C11—H11C | 109.5 |
| O6—Ca1—O1 | 82.27 (3) | H11B—C11—H11C | 109.5 |
| O4i—Ca1—O1i | 86.72 (4) | C9—C12—H12A | 109.5 |
| O4—Ca1—O1i | 93.28 (4) | C9—C12—H12B | 109.5 |
| O6i—Ca1—O1i | 82.27 (3) | H12A—C12—H12B | 109.5 |
| O6—Ca1—O1i | 97.73 (3) | C9—C12—H12C | 109.5 |
| O1—Ca1—O1i | 179.999 (17) | H12A—C12—H12C | 109.5 |
| C13—O1—Zn1 | 105.63 (8) | H12B—C12—H12C | 109.5 |
| C13—O1—Ca1 | 146.51 (8) | O2—C13—O1 | 122.19 (12) |
| Zn1—O1—Ca1 | 104.79 (4) | O2—C13—C14 | 121.36 (13) |
| C15—O3—Zn1 | 119.31 (8) | O1—C13—C14 | 116.44 (12) |
| C15—O4—Ca1 | 136.47 (8) | C13—C14—H14A | 109.5 |
| C17—O5—Zn1 | 120.05 (8) | C13—C14—H14B | 109.5 |
| C17—O6—Ca1 | 140.65 (8) | H14A—C14—H14B | 109.5 |
| C1—N1—C5 | 119.60 (11) | C13—C14—H14C | 109.5 |
| C1—N1—Zn1 | 122.94 (9) | H14A—C14—H14C | 109.5 |
| C5—N1—Zn1 | 117.12 (9) | H14B—C14—H14C | 109.5 |
| C10—N2—C6 | 119.69 (11) | O4—C15—O3 | 124.57 (12) |
| C10—N2—Zn1 | 125.10 (8) | O4—C15—C16 | 118.87 (12) |
| C6—N2—Zn1 | 115.00 (9) | O3—C15—C16 | 116.56 (12) |
| N1—C1—C2 | 123.20 (13) | C15—C16—H16A | 109.5 |
| N1—C1—H1 | 118.4 | C15—C16—H16B | 109.5 |
| C2—C1—H1 | 118.4 | H16A—C16—H16B | 109.5 |
| C3—C2—C1 | 117.19 (13) | C15—C16—H16C | 109.5 |
| C3—C2—C11 | 122.54 (13) | H16A—C16—H16C | 109.5 |
| C1—C2—C11 | 120.27 (14) | H16B—C16—H16C | 109.5 |
| C4—C3—C2 | 120.09 (12) | O6—C17—O5 | 125.19 (11) |
| C4—C3—H3 | 120.0 | O6—C17—C18 | 118.20 (11) |
| C2—C3—H3 | 120.0 | O5—C17—C18 | 116.61 (11) |
| C3—C4—C5 | 119.08 (13) | C17—C18—H18A | 109.5 |
| C3—C4—H4 | 120.5 | C17—C18—H18B | 109.5 |
| C5—C4—H4 | 120.5 | H18A—C18—H18B | 109.5 |
| N1—C5—C4 | 120.82 (13) | C17—C18—H18C | 109.5 |
| N1—C5—C6 | 115.76 (10) | H18A—C18—H18C | 109.5 |
| C4—C5—C6 | 123.42 (12) | H18B—C18—H18C | 109.5 |
| N2—C6—C7 | 120.96 (12) | ||
| O3—Zn1—O1—C13 | −167.59 (7) | O1—Zn1—N2—C6 | 148.38 (9) |
| O5—Zn1—O1—C13 | 91.19 (8) | N1—Zn1—N2—C6 | 5.87 (8) |
| N1—Zn1—O1—C13 | −15.15 (11) | C5—N1—C1—C2 | −0.71 (19) |
| N2—Zn1—O1—C13 | −80.09 (8) | Zn1—N1—C1—C2 | 172.43 (10) |
| Ca1—Zn1—O1—C13 | 165.81 (10) | N1—C1—C2—C3 | −0.8 (2) |
| O3—Zn1—O1—Ca1 | 26.60 (5) | N1—C1—C2—C11 | 179.41 (13) |
| O5—Zn1—O1—Ca1 | −74.63 (4) | C1—C2—C3—C4 | 1.7 (2) |
| N1—Zn1—O1—Ca1 | 179.04 (5) | C11—C2—C3—C4 | −178.52 (14) |
| N2—Zn1—O1—Ca1 | 114.10 (4) | C2—C3—C4—C5 | −1.1 (2) |
| O4i—Ca1—O1—C13 | −12.60 (15) | C1—N1—C5—C4 | 1.28 (18) |
| O4—Ca1—O1—C13 | 167.40 (15) | Zn1—N1—C5—C4 | −172.25 (9) |
| O6i—Ca1—O1—C13 | 74.37 (15) | C1—N1—C5—C6 | −179.45 (11) |
| O6—Ca1—O1—C13 | −105.63 (15) | Zn1—N1—C5—C6 | 7.02 (13) |
| O4i—Ca1—O1—Zn1 | 142.08 (4) | C3—C4—C5—N1 | −0.37 (19) |
| O4—Ca1—O1—Zn1 | −37.92 (4) | C3—C4—C5—C6 | −179.58 (11) |
| O6i—Ca1—O1—Zn1 | −130.95 (4) | C10—N2—C6—C7 | 0.24 (17) |
| O6—Ca1—O1—Zn1 | 49.05 (4) | Zn1—N2—C6—C7 | 175.22 (9) |
| O5—Zn1—O3—C15 | 103.30 (9) | C10—N2—C6—C5 | −179.08 (10) |
| O1—Zn1—O3—C15 | 2.69 (10) | Zn1—N2—C6—C5 | −4.10 (13) |
| N1—Zn1—O3—C15 | −159.58 (9) | N1—C5—C6—N2 | −1.71 (15) |
| N2—Zn1—O3—C15 | −83.12 (9) | C4—C5—C6—N2 | 177.54 (11) |
| O6i—Ca1—O4—C15 | 165.69 (13) | N1—C5—C6—C7 | 178.99 (11) |
| O6—Ca1—O4—C15 | −14.31 (13) | C4—C5—C6—C7 | −1.76 (19) |
| O1—Ca1—O4—C15 | 68.13 (13) | N2—C6—C7—C8 | −1.36 (18) |
| O1i—Ca1—O4—C15 | −111.87 (13) | C5—C6—C7—C8 | 177.90 (12) |
| O3—Zn1—O5—C17 | −68.30 (10) | C6—C7—C8—C9 | 1.38 (19) |
| O1—Zn1—O5—C17 | 53.08 (10) | C7—C8—C9—C10 | −0.33 (19) |
| N1—Zn1—O5—C17 | −166.04 (10) | C7—C8—C9—C12 | −178.98 (12) |
| O4i—Ca1—O6—C17 | −89.17 (14) | C6—N2—C10—C9 | 0.90 (18) |
| O4—Ca1—O6—C17 | 90.83 (14) | Zn1—N2—C10—C9 | −173.54 (9) |
| O1—Ca1—O6—C17 | 3.67 (14) | C8—C9—C10—N2 | −0.85 (18) |
| O1i—Ca1—O6—C17 | −176.33 (14) | C12—C9—C10—N2 | 177.85 (12) |
| O3—Zn1—N1—C1 | −92.32 (10) | Zn1—O1—C13—O2 | −8.12 (14) |
| O5—Zn1—N1—C1 | 5.29 (10) | Ca1—O1—C13—O2 | 146.45 (12) |
| O1—Zn1—N1—C1 | 111.43 (10) | Zn1—O1—C13—C14 | 170.85 (9) |
| N2—Zn1—N1—C1 | 179.79 (11) | Ca1—O1—C13—C14 | −34.6 (2) |
| O3—Zn1—N1—C5 | 80.97 (9) | Ca1—O4—C15—O3 | −47.00 (19) |
| O5—Zn1—N1—C5 | 178.58 (9) | Ca1—O4—C15—C16 | 132.51 (12) |
| O1—Zn1—N1—C5 | −75.27 (11) | Zn1—O3—C15—O4 | −0.07 (17) |
| N2—Zn1—N1—C5 | −6.91 (8) | Zn1—O3—C15—C16 | −179.59 (9) |
| O3—Zn1—N2—C10 | 83.33 (10) | Ca1—O6—C17—O5 | −35.1 (2) |
| O1—Zn1—N2—C10 | −36.95 (10) | Ca1—O6—C17—C18 | 145.71 (11) |
| N1—Zn1—N2—C10 | −179.46 (10) | Zn1—O5—C17—O6 | −0.38 (18) |
| O3—Zn1—N2—C6 | −91.33 (9) | Zn1—O5—C17—C18 | 178.85 (8) |