| Literature DB >> 21581714 |
Shao-Bin Miao1, Lu-Lu Zang, Ya-Wei Fan, Bao-Ming Ji.
Abstract
In the title compound, C(26)H(20)N(6)O(4), the two aroylhydrazone side groups exist as diastereomeres, both in the keto form in the crystal structure. The aroylhydrazone units support the mol-ecular conformation through an intra-molecular N-H⋯O hydrogen bond. Two mol-ecules are connected into a centrosymmetric dimer by inter-molecular N-H⋯N hydrogen bonds. These dimers are connected into chains along the a axis by inter-molecular O-H⋯O hydrogen bonds. The combination of these hydrogen bonds results in layers in the bc plane. The layers are further linked by weak C-H⋯π contacts to form a three-dimensional network structure.Entities:
Year: 2008 PMID: 21581714 PMCID: PMC2967985 DOI: 10.1107/S1600536808038087
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| C26H20N6O4 | |
| Triclinic, | |
| Mo | |
| Cell parameters from 2245 reflections | |
| θ = 2.4–23.8° | |
| α = 98.842 (2)° | µ = 0.10 mm−1 |
| β = 108.895 (2)° | |
| γ = 104.591 (2)° | Block, yellow |
| 0.37 × 0.25 × 0.10 mm |
| Bruker SMART CCD area-detector diffractometer | 4281 independent reflections |
| Radiation source: fine-focus sealed tube | 3119 reflections with |
| graphite | |
| φ and ω scans | θmax = 25.5°, θmin = 2.4° |
| Absorption correction: multi-scan ( | |
| 8593 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 | |
| 4281 reflections | (Δ/σ)max < 0.001 |
| 327 parameters | Δρmax = 0.46 e Å−3 |
| 0 restraints | Δρmin = −0.19 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 |
| O1 | 0.91934 (18) | 0.72851 (13) | 0.61871 (15) | 0.0628 (4) | |
| H1 | 0.8614 | 0.7551 | 0.5702 | 0.094* | |
| O2 | 0.54744 (16) | 0.76483 (12) | 0.33652 (13) | 0.0531 (4) | |
| O3 | 0.03313 (14) | 0.63641 (12) | 0.00365 (11) | 0.0452 (3) | |
| O4 | 0.76743 (15) | 0.68107 (15) | 0.01770 (12) | 0.0586 (4) | |
| H4 | 0.8519 | 0.6749 | 0.0170 | 0.088* | |
| N1 | 0.81685 (17) | 0.90089 (14) | 0.53315 (14) | 0.0400 (4) | |
| N2 | 0.70967 (17) | 0.94879 (14) | 0.46351 (13) | 0.0399 (4) | |
| H2D | 0.7280 | 1.0261 | 0.4795 | 0.048* | |
| N3 | 0.20060 (19) | 0.93570 (15) | 0.21026 (14) | 0.0458 (4) | |
| N4 | 0.23711 (19) | 0.79268 (14) | 0.42134 (13) | 0.0413 (4) | |
| N5 | 0.29163 (16) | 0.65006 (13) | 0.09343 (13) | 0.0370 (4) | |
| H5D | 0.3693 | 0.6630 | 0.1609 | 0.044* | |
| N6 | 0.31480 (17) | 0.62971 (13) | −0.01446 (13) | 0.0355 (4) | |
| C1 | 1.0361 (2) | 0.82252 (18) | 0.70788 (18) | 0.0448 (5) | |
| C2 | 1.1409 (3) | 0.7965 (2) | 0.8036 (2) | 0.0579 (6) | |
| H2 | 1.1310 | 0.7160 | 0.8046 | 0.070* | |
| C3 | 1.2592 (3) | 0.8884 (2) | 0.8969 (2) | 0.0645 (7) | |
| H3 | 1.3274 | 0.8694 | 0.9612 | 0.077* | |
| C4 | 1.2783 (3) | 1.0079 (2) | 0.8970 (2) | 0.0607 (6) | |
| H4A | 1.3601 | 1.0695 | 0.9598 | 0.073* | |
| C5 | 1.1754 (2) | 1.03568 (19) | 0.80321 (18) | 0.0488 (5) | |
| H5 | 1.1873 | 1.1167 | 0.8038 | 0.059* | |
| C6 | 1.0531 (2) | 0.94455 (17) | 0.70696 (16) | 0.0383 (4) | |
| C7 | 0.9401 (2) | 0.97971 (17) | 0.61685 (16) | 0.0385 (4) | |
| H7 | 0.9575 | 1.0617 | 0.6199 | 0.046* | |
| C8 | 0.5773 (2) | 0.87486 (17) | 0.37108 (16) | 0.0375 (4) | |
| C9 | 0.4686 (2) | 0.93978 (16) | 0.31156 (15) | 0.0348 (4) | |
| C10 | 0.5244 (2) | 1.05037 (17) | 0.28697 (17) | 0.0423 (5) | |
| H10 | 0.6328 | 1.0889 | 0.3118 | 0.051* | |
| C11 | 0.4186 (3) | 1.10226 (19) | 0.22581 (19) | 0.0509 (5) | |
| H11 | 0.4541 | 1.1773 | 0.2107 | 0.061* | |
| C12 | 0.2594 (3) | 1.04164 (19) | 0.18726 (19) | 0.0518 (5) | |
| H12 | 0.1885 | 1.0759 | 0.1428 | 0.062* | |
| C13 | 0.3044 (2) | 0.88770 (16) | 0.27334 (15) | 0.0340 (4) | |
| C14 | 0.22940 (19) | 0.77607 (16) | 0.30632 (15) | 0.0332 (4) | |
| C15 | 0.1631 (2) | 0.69644 (19) | 0.45134 (18) | 0.0488 (5) | |
| H15 | 0.1702 | 0.7059 | 0.5313 | 0.059* | |
| C16 | 0.0775 (2) | 0.58480 (19) | 0.37127 (18) | 0.0514 (5) | |
| H16 | 0.0274 | 0.5208 | 0.3964 | 0.062* | |
| C17 | 0.0671 (2) | 0.56921 (18) | 0.25305 (18) | 0.0459 (5) | |
| H17 | 0.0075 | 0.4950 | 0.1963 | 0.055* | |
| C18 | 0.14672 (19) | 0.66555 (16) | 0.21967 (15) | 0.0334 (4) | |
| C19 | 0.1497 (2) | 0.65002 (15) | 0.09467 (16) | 0.0333 (4) | |
| C20 | 0.4561 (2) | 0.63447 (16) | −0.00311 (16) | 0.0359 (4) | |
| H20 | 0.5342 | 0.6531 | 0.0740 | 0.043* | |
| C21 | 0.4959 (2) | 0.61090 (16) | −0.11018 (16) | 0.0358 (4) | |
| C22 | 0.3798 (2) | 0.5622 (2) | −0.22627 (19) | 0.0532 (5) | |
| H22 | 0.2738 | 0.5441 | −0.2363 | 0.064* | |
| C23 | 0.4176 (3) | 0.5402 (2) | −0.3266 (2) | 0.0697 (7) | |
| H23 | 0.3381 | 0.5068 | −0.4036 | 0.084* | |
| C24 | 0.5753 (3) | 0.5682 (2) | −0.3121 (2) | 0.0662 (7) | |
| H24 | 0.6017 | 0.5546 | −0.3798 | 0.079* | |
| C25 | 0.6928 (2) | 0.6157 (2) | −0.1985 (2) | 0.0522 (5) | |
| H25 | 0.7985 | 0.6345 | −0.1897 | 0.063* | |
| C26 | 0.6548 (2) | 0.63589 (16) | −0.09660 (17) | 0.0385 (4) |
| O1 | 0.0565 (10) | 0.0435 (9) | 0.0758 (11) | 0.0107 (7) | 0.0136 (8) | 0.0147 (8) |
| O2 | 0.0472 (8) | 0.0374 (8) | 0.0581 (9) | 0.0142 (6) | 0.0026 (7) | 0.0033 (7) |
| O3 | 0.0298 (7) | 0.0663 (9) | 0.0356 (7) | 0.0159 (6) | 0.0098 (6) | 0.0071 (6) |
| O4 | 0.0326 (7) | 0.0918 (12) | 0.0490 (9) | 0.0242 (8) | 0.0154 (7) | 0.0044 (8) |
| N1 | 0.0359 (9) | 0.0441 (9) | 0.0378 (9) | 0.0142 (7) | 0.0103 (7) | 0.0102 (7) |
| N2 | 0.0383 (9) | 0.0361 (8) | 0.0381 (9) | 0.0111 (7) | 0.0074 (7) | 0.0068 (7) |
| N3 | 0.0452 (9) | 0.0520 (10) | 0.0467 (10) | 0.0221 (8) | 0.0181 (8) | 0.0186 (8) |
| N4 | 0.0500 (10) | 0.0399 (9) | 0.0317 (8) | 0.0123 (7) | 0.0153 (7) | 0.0064 (7) |
| N5 | 0.0292 (8) | 0.0504 (9) | 0.0291 (8) | 0.0124 (7) | 0.0101 (6) | 0.0065 (7) |
| N6 | 0.0335 (8) | 0.0437 (9) | 0.0326 (8) | 0.0135 (7) | 0.0161 (7) | 0.0095 (7) |
| C1 | 0.0385 (11) | 0.0479 (12) | 0.0504 (12) | 0.0120 (9) | 0.0201 (10) | 0.0154 (10) |
| C2 | 0.0535 (13) | 0.0611 (14) | 0.0708 (15) | 0.0250 (12) | 0.0247 (12) | 0.0357 (13) |
| C3 | 0.0524 (14) | 0.0918 (19) | 0.0571 (15) | 0.0310 (14) | 0.0166 (12) | 0.0371 (14) |
| C4 | 0.0484 (13) | 0.0759 (17) | 0.0448 (13) | 0.0172 (12) | 0.0056 (10) | 0.0110 (12) |
| C5 | 0.0435 (11) | 0.0510 (12) | 0.0456 (12) | 0.0153 (10) | 0.0109 (10) | 0.0081 (10) |
| C6 | 0.0333 (10) | 0.0468 (11) | 0.0373 (10) | 0.0147 (8) | 0.0151 (8) | 0.0114 (9) |
| C7 | 0.0376 (10) | 0.0400 (10) | 0.0377 (10) | 0.0116 (9) | 0.0152 (9) | 0.0086 (9) |
| C8 | 0.0348 (10) | 0.0388 (11) | 0.0364 (10) | 0.0099 (8) | 0.0130 (8) | 0.0066 (9) |
| C9 | 0.0375 (10) | 0.0352 (10) | 0.0293 (9) | 0.0102 (8) | 0.0122 (8) | 0.0055 (8) |
| C10 | 0.0417 (11) | 0.0403 (11) | 0.0392 (11) | 0.0068 (9) | 0.0136 (9) | 0.0091 (9) |
| C11 | 0.0616 (14) | 0.0428 (11) | 0.0529 (13) | 0.0168 (10) | 0.0239 (11) | 0.0208 (10) |
| C12 | 0.0580 (14) | 0.0552 (13) | 0.0560 (13) | 0.0299 (11) | 0.0241 (11) | 0.0279 (11) |
| C13 | 0.0376 (10) | 0.0346 (9) | 0.0303 (9) | 0.0135 (8) | 0.0137 (8) | 0.0049 (8) |
| C14 | 0.0284 (9) | 0.0380 (10) | 0.0325 (10) | 0.0119 (8) | 0.0105 (8) | 0.0075 (8) |
| C15 | 0.0593 (13) | 0.0515 (12) | 0.0343 (11) | 0.0107 (10) | 0.0214 (10) | 0.0114 (10) |
| C16 | 0.0588 (13) | 0.0451 (12) | 0.0437 (12) | −0.0009 (10) | 0.0259 (10) | 0.0083 (10) |
| C17 | 0.0441 (11) | 0.0420 (11) | 0.0416 (11) | −0.0001 (9) | 0.0187 (9) | 0.0008 (9) |
| C18 | 0.0278 (9) | 0.0383 (10) | 0.0328 (10) | 0.0097 (8) | 0.0125 (8) | 0.0050 (8) |
| C19 | 0.0290 (9) | 0.0350 (9) | 0.0329 (10) | 0.0078 (7) | 0.0118 (8) | 0.0042 (8) |
| C20 | 0.0317 (10) | 0.0380 (10) | 0.0393 (10) | 0.0133 (8) | 0.0133 (8) | 0.0103 (8) |
| C21 | 0.0352 (10) | 0.0385 (10) | 0.0405 (10) | 0.0172 (8) | 0.0180 (8) | 0.0121 (8) |
| C22 | 0.0364 (11) | 0.0719 (15) | 0.0470 (12) | 0.0183 (10) | 0.0143 (10) | 0.0058 (11) |
| C23 | 0.0567 (14) | 0.107 (2) | 0.0413 (13) | 0.0328 (14) | 0.0159 (11) | 0.0042 (13) |
| C24 | 0.0662 (16) | 0.102 (2) | 0.0461 (13) | 0.0416 (14) | 0.0315 (12) | 0.0171 (13) |
| C25 | 0.0450 (12) | 0.0731 (15) | 0.0542 (13) | 0.0296 (11) | 0.0289 (11) | 0.0208 (11) |
| C26 | 0.0369 (10) | 0.0415 (10) | 0.0422 (11) | 0.0184 (8) | 0.0170 (9) | 0.0108 (9) |
| O1—C1 | 1.358 (2) | C8—C9 | 1.494 (2) |
| O1—H1 | 0.8200 | C9—C10 | 1.390 (2) |
| O2—C8 | 1.226 (2) | C9—C13 | 1.398 (2) |
| O3—C19 | 1.229 (2) | C10—C11 | 1.371 (3) |
| O4—C26 | 1.359 (2) | C10—H10 | 0.9300 |
| O4—H4 | 0.8200 | C11—C12 | 1.372 (3) |
| N1—C7 | 1.279 (2) | C11—H11 | 0.9300 |
| N1—N2 | 1.387 (2) | C12—H12 | 0.9300 |
| N2—C8 | 1.345 (2) | C13—C14 | 1.502 (2) |
| N2—H2D | 0.8600 | C14—C18 | 1.390 (2) |
| N3—C13 | 1.335 (2) | C15—C16 | 1.371 (3) |
| N3—C12 | 1.340 (2) | C15—H15 | 0.9300 |
| N4—C15 | 1.338 (2) | C16—C17 | 1.374 (3) |
| N4—C14 | 1.344 (2) | C16—H16 | 0.9300 |
| N5—C19 | 1.343 (2) | C17—C18 | 1.384 (2) |
| N5—N6 | 1.3807 (19) | C17—H17 | 0.9300 |
| N5—H5D | 0.8600 | C18—C19 | 1.498 (2) |
| N6—C20 | 1.280 (2) | C20—C21 | 1.461 (2) |
| C1—C2 | 1.386 (3) | C20—H20 | 0.9300 |
| C1—C6 | 1.406 (3) | C21—C22 | 1.388 (3) |
| C2—C3 | 1.372 (3) | C21—C26 | 1.401 (2) |
| C2—H2 | 0.9300 | C22—C23 | 1.372 (3) |
| C3—C4 | 1.371 (3) | C22—H22 | 0.9300 |
| C3—H3 | 0.9300 | C23—C24 | 1.383 (3) |
| C4—C5 | 1.373 (3) | C23—H23 | 0.9300 |
| C4—H4A | 0.9300 | C24—C25 | 1.372 (3) |
| C5—C6 | 1.397 (3) | C24—H24 | 0.9300 |
| C5—H5 | 0.9300 | C25—C26 | 1.388 (3) |
| C6—C7 | 1.447 (2) | C25—H25 | 0.9300 |
| C7—H7 | 0.9300 | ||
| C1—O1—H1 | 109.5 | N3—C12—C11 | 123.45 (19) |
| C26—O4—H4 | 109.5 | N3—C12—H12 | 118.3 |
| C7—N1—N2 | 114.91 (16) | C11—C12—H12 | 118.3 |
| C8—N2—N1 | 120.29 (15) | N3—C13—C9 | 123.44 (16) |
| C8—N2—H2D | 119.9 | N3—C13—C14 | 113.82 (15) |
| N1—N2—H2D | 119.9 | C9—C13—C14 | 122.65 (15) |
| C13—N3—C12 | 117.24 (17) | N4—C14—C18 | 122.77 (16) |
| C15—N4—C14 | 117.06 (16) | N4—C14—C13 | 115.72 (15) |
| C19—N5—N6 | 121.03 (14) | C18—C14—C13 | 121.31 (15) |
| C19—N5—H5D | 119.5 | N4—C15—C16 | 123.90 (18) |
| N6—N5—H5D | 119.5 | N4—C15—H15 | 118.1 |
| C20—N6—N5 | 114.90 (14) | C16—C15—H15 | 118.1 |
| O1—C1—C2 | 118.42 (19) | C15—C16—C17 | 118.71 (18) |
| O1—C1—C6 | 122.38 (17) | C15—C16—H16 | 120.6 |
| C2—C1—C6 | 119.20 (19) | C17—C16—H16 | 120.6 |
| C3—C2—C1 | 120.6 (2) | C16—C17—C18 | 119.02 (18) |
| C3—C2—H2 | 119.7 | C16—C17—H17 | 120.5 |
| C1—C2—H2 | 119.7 | C18—C17—H17 | 120.5 |
| C4—C3—C2 | 121.0 (2) | C17—C18—C14 | 118.48 (16) |
| C4—C3—H3 | 119.5 | C17—C18—C19 | 120.92 (16) |
| C2—C3—H3 | 119.5 | C14—C18—C19 | 120.56 (15) |
| C3—C4—C5 | 119.4 (2) | O3—C19—N5 | 124.31 (16) |
| C3—C4—H4A | 120.3 | O3—C19—C18 | 123.07 (15) |
| C5—C4—H4A | 120.3 | N5—C19—C18 | 112.61 (15) |
| C4—C5—C6 | 121.3 (2) | N6—C20—C21 | 120.59 (16) |
| C4—C5—H5 | 119.4 | N6—C20—H20 | 119.7 |
| C6—C5—H5 | 119.4 | C21—C20—H20 | 119.7 |
| C5—C6—C1 | 118.61 (17) | C22—C21—C26 | 118.43 (17) |
| C5—C6—C7 | 118.48 (18) | C22—C21—C20 | 121.77 (16) |
| C1—C6—C7 | 122.62 (17) | C26—C21—C20 | 119.79 (16) |
| N1—C7—C6 | 121.70 (18) | C23—C22—C21 | 121.58 (19) |
| N1—C7—H7 | 119.2 | C23—C22—H22 | 119.2 |
| C6—C7—H7 | 119.2 | C21—C22—H22 | 119.2 |
| O2—C8—N2 | 124.11 (17) | C22—C23—C24 | 119.3 (2) |
| O2—C8—C9 | 122.32 (16) | C22—C23—H23 | 120.3 |
| N2—C8—C9 | 113.56 (16) | C24—C23—H23 | 120.3 |
| C10—C9—C13 | 117.33 (16) | C25—C24—C23 | 120.5 (2) |
| C10—C9—C8 | 122.09 (17) | C25—C24—H24 | 119.7 |
| C13—C9—C8 | 120.52 (16) | C23—C24—H24 | 119.7 |
| C11—C10—C9 | 119.50 (18) | C24—C25—C26 | 120.28 (19) |
| C11—C10—H10 | 120.3 | C24—C25—H25 | 119.9 |
| C9—C10—H10 | 120.3 | C26—C25—H25 | 119.9 |
| C10—C11—C12 | 118.93 (18) | O4—C26—C25 | 122.21 (17) |
| C10—C11—H11 | 120.5 | O4—C26—C21 | 117.96 (16) |
| C12—C11—H11 | 120.5 | C25—C26—C21 | 119.82 (18) |
| C7—N1—N2—C8 | 178.55 (16) | C15—N4—C14—C13 | 176.13 (16) |
| C19—N5—N6—C20 | 178.69 (16) | N3—C13—C14—N4 | −101.74 (18) |
| O1—C1—C2—C3 | −178.8 (2) | C9—C13—C14—N4 | 74.8 (2) |
| C6—C1—C2—C3 | 0.5 (3) | N3—C13—C14—C18 | 73.3 (2) |
| C1—C2—C3—C4 | −1.1 (4) | C9—C13—C14—C18 | −110.1 (2) |
| C2—C3—C4—C5 | 1.3 (4) | C14—N4—C15—C16 | −2.0 (3) |
| C3—C4—C5—C6 | −1.0 (3) | N4—C15—C16—C17 | 0.6 (3) |
| C4—C5—C6—C1 | 0.4 (3) | C15—C16—C17—C18 | 1.7 (3) |
| C4—C5—C6—C7 | 174.46 (19) | C16—C17—C18—C14 | −2.4 (3) |
| O1—C1—C6—C5 | 179.16 (18) | C16—C17—C18—C19 | 175.03 (17) |
| C2—C1—C6—C5 | −0.1 (3) | N4—C14—C18—C17 | 1.0 (3) |
| O1—C1—C6—C7 | 5.3 (3) | C13—C14—C18—C17 | −173.68 (16) |
| C2—C1—C6—C7 | −173.96 (18) | N4—C14—C18—C19 | −176.47 (16) |
| N2—N1—C7—C6 | 171.98 (15) | C13—C14—C18—C19 | 8.9 (2) |
| C5—C6—C7—N1 | −173.13 (17) | N6—N5—C19—O3 | −2.5 (3) |
| C1—C6—C7—N1 | 0.7 (3) | N6—N5—C19—C18 | 176.19 (14) |
| N1—N2—C8—O2 | −5.5 (3) | C17—C18—C19—O3 | 71.2 (2) |
| N1—N2—C8—C9 | 175.49 (14) | C14—C18—C19—O3 | −111.4 (2) |
| O2—C8—C9—C10 | −137.05 (19) | C17—C18—C19—N5 | −107.46 (19) |
| N2—C8—C9—C10 | 42.0 (2) | C14—C18—C19—N5 | 69.9 (2) |
| O2—C8—C9—C13 | 40.0 (3) | N5—N6—C20—C21 | 178.09 (14) |
| N2—C8—C9—C13 | −140.91 (17) | N6—C20—C21—C22 | −11.5 (3) |
| C13—C9—C10—C11 | −1.0 (3) | N6—C20—C21—C26 | 169.45 (17) |
| C8—C9—C10—C11 | 176.21 (17) | C26—C21—C22—C23 | −1.0 (3) |
| C9—C10—C11—C12 | −1.8 (3) | C20—C21—C22—C23 | −180.0 (2) |
| C13—N3—C12—C11 | −0.5 (3) | C21—C22—C23—C24 | −0.6 (4) |
| C10—C11—C12—N3 | 2.7 (3) | C22—C23—C24—C25 | 1.0 (4) |
| C12—N3—C13—C9 | −2.6 (3) | C23—C24—C25—C26 | 0.3 (4) |
| C12—N3—C13—C14 | 173.98 (16) | C24—C25—C26—O4 | 179.0 (2) |
| C10—C9—C13—N3 | 3.3 (3) | C24—C25—C26—C21 | −1.9 (3) |
| C8—C9—C13—N3 | −173.91 (16) | C22—C21—C26—O4 | −178.60 (18) |
| C10—C9—C13—C14 | −172.94 (16) | C20—C21—C26—O4 | 0.4 (3) |
| C8—C9—C13—C14 | 9.8 (3) | C22—C21—C26—C25 | 2.2 (3) |
| C15—N4—C14—C18 | 1.2 (3) | C20—C21—C26—C25 | −178.76 (17) |
| H··· | ||||
| N5—H5D···O2 | 0.86 | 2.15 | 2.962 (2) | 157 |
| N2—H2D···N4i | 0.86 | 2.17 | 2.985 (2) | 159 |
| O4—H4···O3ii | 0.82 | 1.92 | 2.736 (2) | 172 |
| O1—H1···N1 | 0.82 | 1.95 | 2.663 (2) | 145 |
| C10—H10···Cg3iii | 0.93 | 2.76 | 3.458 (2) | 133 |
| C11—H11···Cg4iv | 0.93 | 2.73 | 3.588 (2) | 154 |
Hydrogen-bond geometry (Å, °)
Cg3 and Cg4 are the centroids of the benzene rings C1–C6 and C21–C26, respectively.
| H⋯ | ||||
|---|---|---|---|---|
| N5—H5 | 0.86 | 2.15 | 2.962 (2) | 157 |
| N2—H2 | 0.86 | 2.17 | 2.985 (2) | 159 |
| O4—H4⋯O3ii | 0.82 | 1.92 | 2.736 (2) | 172 |
| O1—H1⋯N1 | 0.82 | 1.95 | 2.663 (2) | 145 |
| C10—H10⋯ | 0.93 | 2.76 | 3.458 (2) | 133 |
| C11—H11⋯ | 0.93 | 2.73 | 3.588 (2) | 154 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) .