| Literature DB >> 21588176 |
Gholamhossein Mohammadnezhad, Ali Reza Ghanbarpour, Mostafa M Amini, Seik Weng Ng.
Abstract
The Pb(II) atom in the title compound, [Pb(C(10)H(6)NO(2))(2)], is N,O-chelated by two quinoline-2-carboxyl-ate anions in a distorted Ψ-trigonal-bipyramidal environment; four atoms are connected to the Pb(II) atom by regular coordination bonds. The structure also features two somewhat long Pb⋯O inter-actions [2.952 (3) and 3.014 (3) Å]. These long inter-actions give rise to a layer coordination polymer having the lead atom in a distorted Ψ-monocapped octa-hedral geometry.Entities:
Year: 2010 PMID: 21588176 PMCID: PMC3007439 DOI: 10.1107/S1600536810027509
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Pb(C10H6NO2)2] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 3819 reflections |
| θ = 2.6–28.3° | |
| µ = 10.52 mm−1 | |
| β = 108.981 (1)° | Prism, colorless |
| 0.15 × 0.10 × 0.05 mm | |
| Bruker SMART APEX diffractometer | 3669 independent reflections |
| Radiation source: fine-focus sealed tube | 3119 reflections with |
| graphite | |
| ω scans | θmax = 27.5°, θmin = 1.3° |
| Absorption correction: multi-scan ( | |
| 9758 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 | |
| 3669 reflections | (Δ/σ)max = 0.002 |
| 244 parameters | Δρmax = 1.64 e Å−3 |
| 6 restraints | Δρmin = −0.92 e Å−3 |
| Pb1 | 0.747914 (11) | 0.70412 (2) | 0.535665 (12) | 0.00980 (6) | |
| O1 | 0.7953 (2) | 0.6837 (4) | 0.4000 (2) | 0.0147 (7) | |
| O2 | 0.7691 (2) | 0.6491 (5) | 0.2362 (2) | 0.0184 (7) | |
| O3 | 0.7075 (2) | 1.0028 (4) | 0.4949 (2) | 0.0144 (7) | |
| O4 | 0.7419 (2) | 1.2990 (4) | 0.4913 (3) | 0.0196 (7) | |
| N1 | 0.6232 (2) | 0.6704 (5) | 0.3714 (3) | 0.0107 (8) | |
| N2 | 0.8766 (2) | 0.9163 (5) | 0.5793 (3) | 0.0114 (8) | |
| C1 | 0.7447 (3) | 0.6590 (6) | 0.3111 (3) | 0.0126 (10) | |
| C2 | 0.6487 (3) | 0.6425 (6) | 0.2937 (3) | 0.0103 (9) | |
| C3 | 0.5919 (3) | 0.6023 (6) | 0.1978 (3) | 0.0131 (9) | |
| H3 | 0.6131 | 0.5808 | 0.1439 | 0.016* | |
| C4 | 0.5058 (3) | 0.5948 (6) | 0.1835 (3) | 0.0138 (9) | |
| H4 | 0.4663 | 0.5701 | 0.1191 | 0.017* | |
| C5 | 0.4753 (3) | 0.6238 (6) | 0.2649 (3) | 0.0136 (9) | |
| C6 | 0.3874 (3) | 0.6160 (6) | 0.2565 (3) | 0.0155 (10) | |
| H6 | 0.3456 | 0.5914 | 0.1936 | 0.019* | |
| C7 | 0.3621 (3) | 0.6437 (6) | 0.3383 (4) | 0.0176 (10) | |
| H7 | 0.3029 | 0.6358 | 0.3320 | 0.021* | |
| C8 | 0.4233 (3) | 0.6839 (6) | 0.4319 (4) | 0.0159 (10) | |
| H8 | 0.4049 | 0.7041 | 0.4880 | 0.019* | |
| C9 | 0.5090 (3) | 0.6940 (6) | 0.4427 (3) | 0.0152 (10) | |
| H9 | 0.5496 | 0.7228 | 0.5058 | 0.018* | |
| C10 | 0.5372 (3) | 0.6615 (6) | 0.3599 (3) | 0.0087 (9) | |
| C11 | 0.7614 (3) | 1.1369 (6) | 0.5093 (3) | 0.0134 (10) | |
| C12 | 0.8565 (3) | 1.0885 (6) | 0.5515 (3) | 0.0104 (9) | |
| C13 | 0.9195 (3) | 1.2240 (6) | 0.5577 (3) | 0.0138 (10) | |
| H13 | 0.9031 | 1.3456 | 0.5356 | 0.017* | |
| C14 | 1.0048 (3) | 1.1769 (6) | 0.5963 (3) | 0.0146 (10) | |
| H14 | 1.0480 | 1.2657 | 0.6002 | 0.018* | |
| C15 | 1.0278 (3) | 0.9972 (6) | 0.6300 (3) | 0.0126 (9) | |
| C16 | 1.1143 (3) | 0.9387 (6) | 0.6713 (3) | 0.0155 (10) | |
| H16 | 1.1597 | 1.0243 | 0.6805 | 0.019* | |
| C17 | 1.1325 (3) | 0.7599 (7) | 0.6981 (3) | 0.0169 (10) | |
| H17 | 1.1907 | 0.7213 | 0.7233 | 0.020* | |
| C18 | 1.0664 (3) | 0.6316 (7) | 0.6888 (3) | 0.0141 (10) | |
| H18 | 1.0803 | 0.5082 | 0.7093 | 0.017* | |
| C19 | 0.9823 (3) | 0.6841 (6) | 0.6505 (3) | 0.0136 (10) | |
| H19 | 0.9379 | 0.5973 | 0.6446 | 0.016* | |
| C20 | 0.9612 (3) | 0.8672 (6) | 0.6195 (3) | 0.0093 (9) |
| Pb1 | 0.00792 (9) | 0.01030 (9) | 0.01183 (8) | −0.00087 (7) | 0.00412 (6) | 0.00058 (7) |
| O1 | 0.0075 (17) | 0.0208 (19) | 0.0172 (16) | −0.0020 (14) | 0.0061 (13) | −0.0022 (13) |
| O2 | 0.0192 (19) | 0.0226 (18) | 0.0175 (16) | 0.0033 (15) | 0.0117 (14) | −0.0028 (14) |
| O3 | 0.0095 (17) | 0.0113 (17) | 0.0208 (16) | −0.0028 (14) | 0.0028 (14) | −0.0009 (13) |
| O4 | 0.020 (2) | 0.0117 (17) | 0.0315 (19) | 0.0039 (15) | 0.0149 (15) | 0.0054 (15) |
| N1 | 0.012 (2) | 0.0061 (18) | 0.0169 (18) | −0.0005 (15) | 0.0080 (16) | 0.0009 (14) |
| N2 | 0.014 (2) | 0.0097 (19) | 0.0115 (17) | −0.0021 (16) | 0.0052 (15) | −0.0014 (14) |
| C1 | 0.013 (3) | 0.008 (2) | 0.020 (2) | 0.0001 (18) | 0.009 (2) | 0.0037 (17) |
| C2 | 0.007 (2) | 0.006 (2) | 0.017 (2) | 0.0002 (17) | 0.0025 (18) | 0.0001 (16) |
| C3 | 0.014 (2) | 0.013 (2) | 0.013 (2) | −0.0032 (19) | 0.0045 (18) | −0.0013 (18) |
| C4 | 0.015 (3) | 0.007 (2) | 0.015 (2) | −0.0004 (19) | −0.0009 (18) | 0.0007 (17) |
| C5 | 0.014 (3) | 0.010 (2) | 0.016 (2) | 0.000 (2) | 0.0039 (19) | 0.0010 (18) |
| C6 | 0.012 (3) | 0.013 (2) | 0.019 (2) | 0.001 (2) | 0.0007 (19) | 0.0007 (19) |
| C7 | 0.010 (3) | 0.015 (2) | 0.026 (3) | 0.000 (2) | 0.004 (2) | 0.0054 (19) |
| C8 | 0.013 (3) | 0.012 (2) | 0.023 (2) | 0.001 (2) | 0.007 (2) | 0.0040 (19) |
| C9 | 0.014 (3) | 0.013 (2) | 0.016 (2) | 0.001 (2) | 0.0012 (19) | 0.0003 (18) |
| C10 | 0.005 (2) | 0.005 (2) | 0.014 (2) | −0.0006 (16) | 0.0015 (17) | 0.0007 (15) |
| C11 | 0.017 (3) | 0.013 (2) | 0.012 (2) | 0.005 (2) | 0.0062 (19) | 0.0029 (17) |
| C12 | 0.013 (2) | 0.012 (2) | 0.0087 (19) | 0.0034 (18) | 0.0066 (17) | −0.0013 (16) |
| C13 | 0.019 (3) | 0.008 (2) | 0.014 (2) | 0.001 (2) | 0.0065 (19) | 0.0034 (17) |
| C14 | 0.015 (3) | 0.013 (2) | 0.017 (2) | −0.0075 (19) | 0.0074 (19) | −0.0052 (18) |
| C15 | 0.014 (2) | 0.013 (2) | 0.013 (2) | −0.0028 (19) | 0.0073 (18) | −0.0023 (17) |
| C16 | 0.010 (2) | 0.017 (2) | 0.020 (2) | −0.0033 (19) | 0.0052 (19) | −0.0039 (19) |
| C17 | 0.012 (3) | 0.021 (3) | 0.016 (2) | 0.004 (2) | 0.0020 (19) | −0.0007 (18) |
| C18 | 0.012 (3) | 0.015 (2) | 0.015 (2) | 0.001 (2) | 0.0041 (19) | 0.0008 (18) |
| C19 | 0.013 (2) | 0.014 (2) | 0.013 (2) | −0.003 (2) | 0.0024 (18) | −0.0011 (18) |
| C20 | 0.007 (2) | 0.013 (2) | 0.0096 (19) | −0.0013 (18) | 0.0049 (17) | −0.0030 (17) |
| Pb1—O1 | 2.304 (3) | C6—H6 | 0.9500 |
| Pb1—O2i | 2.952 (3) | C7—C8 | 1.412 (7) |
| Pb1—O3 | 2.295 (3) | C7—H7 | 0.9500 |
| Pb1—O4ii | 3.014 (3) | C8—C9 | 1.370 (7) |
| Pb1—N1 | 2.567 (4) | C8—H8 | 0.9500 |
| Pb1—N2 | 2.531 (4) | C9—C10 | 1.417 (6) |
| O1—C1 | 1.279 (6) | C9—H9 | 0.9500 |
| O2—C1 | 1.255 (5) | C11—C12 | 1.525 (6) |
| O3—C11 | 1.290 (6) | C12—C13 | 1.413 (6) |
| O4—C11 | 1.229 (5) | C13—C14 | 1.373 (7) |
| N1—C2 | 1.318 (6) | C13—H13 | 0.9500 |
| N1—C10 | 1.370 (6) | C14—C15 | 1.404 (6) |
| N2—C12 | 1.325 (5) | C14—H14 | 0.9500 |
| N2—C20 | 1.368 (6) | C15—C16 | 1.417 (6) |
| C1—C2 | 1.521 (6) | C15—C20 | 1.419 (6) |
| C2—C3 | 1.408 (6) | C16—C17 | 1.363 (6) |
| C3—C4 | 1.366 (6) | C16—H16 | 0.9500 |
| C3—H3 | 0.9500 | C17—C18 | 1.408 (7) |
| C4—C5 | 1.416 (6) | C17—H17 | 0.9500 |
| C4—H4 | 0.9500 | C18—C19 | 1.366 (6) |
| C5—C6 | 1.413 (6) | C18—H18 | 0.9500 |
| C5—C10 | 1.427 (6) | C19—C20 | 1.413 (6) |
| C6—C7 | 1.370 (6) | C19—H19 | 0.9500 |
| O3—Pb1—O1 | 89.98 (11) | C6—C7—H7 | 119.8 |
| O3—Pb1—N2 | 68.45 (11) | C8—C7—H7 | 119.8 |
| O1—Pb1—N2 | 76.13 (11) | C9—C8—C7 | 120.6 (5) |
| O3—Pb1—N1 | 77.38 (11) | C9—C8—H8 | 119.7 |
| O1—Pb1—N1 | 67.90 (11) | C7—C8—H8 | 119.7 |
| N2—Pb1—N1 | 129.71 (11) | C8—C9—C10 | 120.1 (4) |
| O3—Pb1—O2i | 80.37 (10) | C8—C9—H9 | 120.0 |
| O1—Pb1—O2i | 149.57 (10) | C10—C9—H9 | 120.0 |
| N2—Pb1—O2i | 73.48 (10) | N1—C10—C9 | 119.8 (4) |
| N1—Pb1—O2i | 135.90 (11) | N1—C10—C5 | 120.9 (4) |
| O3—Pb1—O4ii | 152.83 (10) | C9—C10—C5 | 119.3 (4) |
| O1—Pb1—O4ii | 76.09 (10) | O4—C11—O3 | 125.2 (4) |
| N2—Pb1—O4ii | 128.16 (11) | O4—C11—C12 | 118.0 (4) |
| N1—Pb1—O4ii | 75.78 (10) | O3—C11—C12 | 116.8 (4) |
| O2i—Pb1—O4ii | 122.81 (9) | N2—C12—C13 | 122.4 (4) |
| C1—O1—Pb1 | 122.9 (3) | N2—C12—C11 | 117.5 (4) |
| C11—O3—Pb1 | 123.4 (3) | C13—C12—C11 | 120.1 (4) |
| C2—N1—C10 | 119.3 (4) | C14—C13—C12 | 118.9 (4) |
| C2—N1—Pb1 | 113.3 (3) | C14—C13—H13 | 120.5 |
| C10—N1—Pb1 | 127.0 (3) | C12—C13—H13 | 120.5 |
| C12—N2—C20 | 119.6 (4) | C13—C14—C15 | 119.8 (4) |
| C12—N2—Pb1 | 113.4 (3) | C13—C14—H14 | 120.1 |
| C20—N2—Pb1 | 126.7 (3) | C15—C14—H14 | 120.1 |
| O2—C1—O1 | 123.9 (4) | C14—C15—C16 | 123.0 (4) |
| O2—C1—C2 | 117.3 (4) | C14—C15—C20 | 118.3 (4) |
| O1—C1—C2 | 118.8 (4) | C16—C15—C20 | 118.6 (4) |
| N1—C2—C3 | 123.3 (4) | C17—C16—C15 | 120.2 (4) |
| N1—C2—C1 | 116.6 (4) | C17—C16—H16 | 119.9 |
| C3—C2—C1 | 120.1 (4) | C15—C16—H16 | 119.9 |
| C4—C3—C2 | 118.8 (4) | C16—C17—C18 | 121.1 (5) |
| C4—C3—H3 | 120.6 | C16—C17—H17 | 119.5 |
| C2—C3—H3 | 120.6 | C18—C17—H17 | 119.5 |
| C3—C4—C5 | 119.9 (4) | C19—C18—C17 | 120.1 (5) |
| C3—C4—H4 | 120.0 | C19—C18—H18 | 119.9 |
| C5—C4—H4 | 120.0 | C17—C18—H18 | 119.9 |
| C6—C5—C4 | 123.3 (4) | C18—C19—C20 | 120.2 (4) |
| C6—C5—C10 | 119.0 (4) | C18—C19—H19 | 119.9 |
| C4—C5—C10 | 117.8 (4) | C20—C19—H19 | 119.9 |
| C7—C6—C5 | 120.5 (4) | N2—C20—C19 | 119.4 (4) |
| C7—C6—H6 | 119.7 | N2—C20—C15 | 121.0 (4) |
| C5—C6—H6 | 119.7 | C19—C20—C15 | 119.6 (4) |
| C6—C7—C8 | 120.5 (5) | ||
| O3—Pb1—O1—C1 | −79.2 (3) | C4—C5—C6—C7 | 179.4 (5) |
| N2—Pb1—O1—C1 | −147.0 (3) | C10—C5—C6—C7 | −0.2 (7) |
| N1—Pb1—O1—C1 | −2.8 (3) | C5—C6—C7—C8 | 1.2 (7) |
| O2i—Pb1—O1—C1 | −149.9 (3) | C6—C7—C8—C9 | −0.7 (7) |
| O4ii—Pb1—O1—C1 | 77.2 (3) | C7—C8—C9—C10 | −0.9 (7) |
| O1—Pb1—O3—C11 | −74.7 (3) | C2—N1—C10—C9 | −179.1 (4) |
| N2—Pb1—O3—C11 | 0.4 (3) | Pb1—N1—C10—C9 | 7.8 (5) |
| N1—Pb1—O3—C11 | −142.0 (3) | C2—N1—C10—C5 | −0.4 (6) |
| O2i—Pb1—O3—C11 | 76.3 (3) | Pb1—N1—C10—C5 | −173.5 (3) |
| O4ii—Pb1—O3—C11 | −132.9 (3) | C8—C9—C10—N1 | −179.5 (4) |
| O3—Pb1—N1—C2 | 100.8 (3) | C8—C9—C10—C5 | 1.9 (6) |
| O1—Pb1—N1—C2 | 5.6 (3) | C6—C5—C10—N1 | −180.0 (4) |
| N2—Pb1—N1—C2 | 53.2 (3) | C4—C5—C10—N1 | 0.4 (6) |
| O2i—Pb1—N1—C2 | 162.2 (3) | C6—C5—C10—C9 | −1.3 (6) |
| O4ii—Pb1—N1—C2 | −75.0 (3) | C4—C5—C10—C9 | 179.1 (4) |
| O3—Pb1—N1—C10 | −85.8 (3) | Pb1—O3—C11—O4 | −177.6 (3) |
| O1—Pb1—N1—C10 | 179.0 (4) | Pb1—O3—C11—C12 | 2.8 (5) |
| N2—Pb1—N1—C10 | −133.3 (3) | C20—N2—C12—C13 | 2.8 (6) |
| O2i—Pb1—N1—C10 | −24.3 (4) | Pb1—N2—C12—C13 | −172.1 (3) |
| O4ii—Pb1—N1—C10 | 98.5 (3) | C20—N2—C12—C11 | −178.7 (3) |
| O3—Pb1—N2—C12 | −3.8 (3) | Pb1—N2—C12—C11 | 6.5 (4) |
| O1—Pb1—N2—C12 | 91.8 (3) | O4—C11—C12—N2 | 173.9 (4) |
| N1—Pb1—N2—C12 | 46.9 (3) | O3—C11—C12—N2 | −6.5 (6) |
| O2i—Pb1—N2—C12 | −89.8 (3) | O4—C11—C12—C13 | −7.6 (6) |
| O4ii—Pb1—N2—C12 | 151.2 (2) | O3—C11—C12—C13 | 172.1 (4) |
| O3—Pb1—N2—C20 | −178.2 (3) | N2—C12—C13—C14 | −1.7 (6) |
| O1—Pb1—N2—C20 | −82.6 (3) | C11—C12—C13—C14 | 179.8 (4) |
| N1—Pb1—N2—C20 | −127.5 (3) | C12—C13—C14—C15 | −0.9 (7) |
| O2i—Pb1—N2—C20 | 95.9 (3) | C13—C14—C15—C16 | −179.5 (4) |
| O4ii—Pb1—N2—C20 | −23.2 (4) | C13—C14—C15—C20 | 2.3 (6) |
| Pb1—O1—C1—O2 | 179.4 (3) | C14—C15—C16—C17 | −176.7 (4) |
| Pb1—O1—C1—C2 | 0.1 (5) | C20—C15—C16—C17 | 1.5 (6) |
| C10—N1—C2—C3 | −0.4 (6) | C15—C16—C17—C18 | −2.4 (7) |
| Pb1—N1—C2—C3 | 173.6 (3) | C16—C17—C18—C19 | 1.5 (7) |
| C10—N1—C2—C1 | 178.5 (4) | C17—C18—C19—C20 | 0.3 (7) |
| Pb1—N1—C2—C1 | −7.5 (5) | C12—N2—C20—C19 | 179.0 (4) |
| O2—C1—C2—N1 | −173.8 (4) | Pb1—N2—C20—C19 | −6.9 (5) |
| O1—C1—C2—N1 | 5.5 (6) | C12—N2—C20—C15 | −1.3 (6) |
| O2—C1—C2—C3 | 5.2 (6) | Pb1—N2—C20—C15 | 172.8 (3) |
| O1—C1—C2—C3 | −175.5 (4) | C18—C19—C20—N2 | 178.6 (4) |
| N1—C2—C3—C4 | 1.2 (7) | C18—C19—C20—C15 | −1.1 (6) |
| C1—C2—C3—C4 | −177.7 (4) | C14—C15—C20—N2 | −1.3 (6) |
| C2—C3—C4—C5 | −1.1 (7) | C16—C15—C20—N2 | −179.5 (4) |
| C3—C4—C5—C6 | −179.2 (4) | C14—C15—C20—C19 | 178.5 (4) |
| C3—C4—C5—C10 | 0.4 (7) | C16—C15—C20—C19 | 0.2 (6) |
Selected bond lengths (Å)
| Pb1—O1 | 2.304 (3) |
| Pb1—O2i | 2.952 (3) |
| Pb1—O3 | 2.295 (3) |
| Pb1—O4ii | 3.014 (3) |
| Pb1—N1 | 2.567 (4) |
| Pb1—N2 | 2.531 (4) |
Symmetry codes: (i) ; (ii) .