| Literature DB >> 21582578 |
Mustafa Odabaşoğlu, Serkan Yavuz, Ozgür Pamir, Yılmaz Yıldırır, Orhan Büyükgüngör.
Abstract
In the mol-ecule of the title compound, C(23)H(27)NO(5), the furan ring adopts an envelope conformation. Intra-molecular C-H⋯O inter-actions result in the formation of S(5) and S(6) motifs. In the crystal structure, weak inter-molecular C-H⋯O hydrogen bonds link the mol-ecules through C(6) and C(8) chains along the [100] and [010] directions, generating a two-dimensional network.Entities:
Year: 2009 PMID: 21582578 PMCID: PMC2968994 DOI: 10.1107/S1600536809009362
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| C23H27NO5 | |
| Orthorhombic, | Mo |
| Hall symbol: P 2ac 2ab | Cell parameters from 27330 reflections |
| θ = 1.4–27.3° | |
| µ = 0.09 mm−1 | |
| Prism, colourless | |
| 0.39 × 0.35 × 0.31 mm |
| Stoe IPDS II diffractometer | 2467 independent reflections |
| Radiation source: fine-focus sealed tube | 2300 reflections with |
| graphite | |
| ω scan rotation method | θmax = 26.8°, θmin = 1.4° |
| Absorption correction: integration ( | |
| 27330 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 | |
| 2467 reflections | (Δ/σ)max = 0.001 |
| 262 parameters | Δρmax = 0.14 e Å−3 |
| 0 restraints | Δρmin = −0.14 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 | 0.9853 (3) | 0.82364 (14) | 0.58760 (5) | 0.0549 (4) | |
| O2 | 0.9330 (2) | 0.60075 (12) | 0.65159 (4) | 0.0386 (3) | |
| O3 | 0.6842 (2) | 0.59127 (12) | 0.73570 (4) | 0.0395 (3) | |
| O4 | 0.2507 (2) | 0.38987 (17) | 0.74242 (5) | 0.0535 (4) | |
| O5 | 0.4979 (2) | 0.37509 (14) | 0.79459 (4) | 0.0460 (3) | |
| N1 | 0.6584 (3) | 0.16016 (16) | 0.58745 (5) | 0.0444 (4) | |
| C1 | 0.9098 (3) | 0.70471 (19) | 0.57577 (7) | 0.0435 (5) | |
| C2 | 0.8226 (4) | 0.6904 (2) | 0.53244 (7) | 0.0521 (5) | |
| H2 | 0.8344 | 0.7572 | 0.5114 | 0.063* | |
| C3 | 0.7190 (4) | 0.5803 (2) | 0.51963 (6) | 0.0503 (5) | |
| H3 | 0.6560 | 0.5766 | 0.4911 | 0.060* | |
| C4 | 0.7078 (3) | 0.47442 (19) | 0.54914 (6) | 0.0415 (4) | |
| C5 | 0.8120 (3) | 0.48664 (17) | 0.59018 (6) | 0.0353 (4) | |
| C6 | 0.8950 (3) | 0.60011 (19) | 0.60527 (6) | 0.0375 (4) | |
| C7 | 1.1676 (5) | 0.8241 (3) | 0.61339 (10) | 0.0721 (7) | |
| H7A | 1.1464 | 0.7790 | 0.6417 | 0.087* | |
| H7B | 1.2068 | 0.9112 | 0.6198 | 0.087* | |
| H7C | 1.2735 | 0.7825 | 0.5962 | 0.087* | |
| C8 | 0.5653 (4) | 0.3625 (2) | 0.54286 (6) | 0.0484 (5) | |
| H8A | 0.6178 | 0.3088 | 0.5184 | 0.058* | |
| H8B | 0.4341 | 0.3953 | 0.5330 | 0.058* | |
| C9 | 0.5316 (3) | 0.27660 (19) | 0.58627 (6) | 0.0410 (4) | |
| H9 | 0.3887 | 0.2491 | 0.5862 | 0.049* | |
| C10 | 0.5680 (3) | 0.35311 (17) | 0.63073 (6) | 0.0337 (4) | |
| C11 | 0.7950 (3) | 0.39378 (17) | 0.62929 (6) | 0.0328 (4) | |
| C12 | 0.5280 (3) | 0.28000 (17) | 0.67567 (6) | 0.0385 (4) | |
| H12A | 0.6025 | 0.1995 | 0.6755 | 0.046* | |
| H12B | 0.3838 | 0.2607 | 0.6784 | 0.046* | |
| C13 | 0.5970 (3) | 0.36300 (17) | 0.71682 (6) | 0.0346 (4) | |
| H13 | 0.7151 | 0.3225 | 0.7315 | 0.042* | |
| C14 | 0.6587 (3) | 0.50225 (16) | 0.69954 (5) | 0.0325 (4) | |
| C15 | 0.8520 (3) | 0.48032 (16) | 0.67040 (6) | 0.0320 (4) | |
| H15 | 0.9566 | 0.4380 | 0.6890 | 0.038* | |
| C16 | 0.4276 (3) | 0.37757 (17) | 0.75171 (6) | 0.0373 (4) | |
| C17 | 0.3443 (4) | 0.3871 (2) | 0.82992 (7) | 0.0582 (6) | |
| H17A | 0.2733 | 0.4671 | 0.8262 | 0.070* | |
| H17B | 0.4082 | 0.3850 | 0.8595 | 0.070* | |
| H17C | 0.2493 | 0.3173 | 0.8274 | 0.070* | |
| C18 | 0.8627 (4) | 0.5760 (2) | 0.76315 (7) | 0.0531 (5) | |
| H18A | 0.8614 | 0.4926 | 0.7772 | 0.064* | |
| H18B | 0.8652 | 0.6409 | 0.7865 | 0.064* | |
| H18C | 0.9815 | 0.5841 | 0.7441 | 0.064* | |
| C19 | 0.4885 (3) | 0.54957 (17) | 0.66960 (6) | 0.0348 (4) | |
| H19 | 0.4201 | 0.6261 | 0.6754 | 0.042* | |
| C20 | 0.4425 (3) | 0.47512 (18) | 0.63434 (6) | 0.0366 (4) | |
| H20 | 0.3410 | 0.4960 | 0.6133 | 0.044* | |
| C21 | 0.9344 (3) | 0.27647 (18) | 0.62531 (6) | 0.0398 (4) | |
| H21A | 1.0739 | 0.3051 | 0.6211 | 0.048* | |
| H21B | 0.9282 | 0.2277 | 0.6536 | 0.048* | |
| C22 | 0.8753 (3) | 0.1899 (2) | 0.58551 (7) | 0.0478 (5) | |
| H22A | 0.9064 | 0.2324 | 0.5567 | 0.057* | |
| H22B | 0.9535 | 0.1109 | 0.5869 | 0.057* | |
| C23 | 0.5999 (4) | 0.0659 (2) | 0.55288 (8) | 0.0594 (6) | |
| H23A | 0.4611 | 0.0401 | 0.5578 | 0.071* | |
| H23B | 0.6873 | −0.0078 | 0.5551 | 0.071* | |
| H23C | 0.6127 | 0.1032 | 0.5229 | 0.071* |
| O1 | 0.0602 (10) | 0.0446 (7) | 0.0601 (9) | −0.0062 (7) | −0.0022 (8) | 0.0136 (7) |
| O2 | 0.0409 (7) | 0.0403 (7) | 0.0345 (6) | −0.0067 (6) | −0.0023 (5) | 0.0046 (5) |
| O3 | 0.0414 (7) | 0.0397 (7) | 0.0374 (6) | 0.0075 (6) | −0.0061 (6) | −0.0074 (5) |
| O4 | 0.0400 (8) | 0.0721 (10) | 0.0485 (7) | 0.0135 (7) | 0.0066 (6) | 0.0086 (7) |
| O5 | 0.0502 (8) | 0.0562 (8) | 0.0317 (6) | −0.0020 (7) | 0.0068 (6) | −0.0015 (6) |
| N1 | 0.0515 (10) | 0.0427 (9) | 0.0390 (8) | −0.0005 (8) | 0.0022 (8) | −0.0086 (7) |
| C1 | 0.0426 (11) | 0.0426 (10) | 0.0454 (10) | −0.0006 (9) | 0.0052 (8) | 0.0082 (8) |
| C2 | 0.0590 (13) | 0.0576 (12) | 0.0398 (10) | 0.0047 (12) | 0.0044 (10) | 0.0176 (9) |
| C3 | 0.0566 (12) | 0.0632 (13) | 0.0310 (8) | 0.0078 (11) | −0.0025 (9) | 0.0083 (8) |
| C4 | 0.0438 (11) | 0.0509 (11) | 0.0299 (8) | 0.0059 (9) | −0.0008 (8) | 0.0013 (8) |
| C5 | 0.0328 (9) | 0.0427 (9) | 0.0305 (8) | 0.0023 (8) | 0.0022 (7) | 0.0042 (7) |
| C6 | 0.0323 (9) | 0.0463 (10) | 0.0338 (8) | 0.0017 (8) | 0.0015 (7) | 0.0046 (7) |
| C7 | 0.0646 (16) | 0.0618 (15) | 0.0900 (19) | −0.0224 (14) | −0.0152 (15) | 0.0162 (14) |
| C8 | 0.0557 (12) | 0.0555 (12) | 0.0339 (9) | 0.0004 (11) | −0.0091 (9) | −0.0025 (8) |
| C9 | 0.0395 (10) | 0.0471 (10) | 0.0363 (9) | −0.0033 (8) | −0.0033 (8) | −0.0044 (8) |
| C10 | 0.0321 (8) | 0.0382 (9) | 0.0307 (8) | −0.0007 (7) | 0.0004 (7) | −0.0010 (7) |
| C11 | 0.0330 (9) | 0.0383 (9) | 0.0271 (7) | 0.0032 (7) | −0.0010 (7) | 0.0019 (7) |
| C12 | 0.0416 (10) | 0.0356 (9) | 0.0384 (9) | −0.0028 (8) | 0.0065 (8) | −0.0018 (7) |
| C13 | 0.0359 (9) | 0.0366 (9) | 0.0313 (8) | 0.0051 (8) | 0.0026 (7) | 0.0025 (7) |
| C14 | 0.0361 (9) | 0.0328 (8) | 0.0287 (8) | 0.0028 (7) | −0.0010 (7) | −0.0011 (6) |
| C15 | 0.0305 (8) | 0.0344 (8) | 0.0311 (8) | 0.0007 (7) | −0.0032 (7) | 0.0034 (7) |
| C16 | 0.0424 (10) | 0.0347 (9) | 0.0347 (9) | 0.0030 (8) | 0.0044 (8) | 0.0033 (7) |
| C17 | 0.0666 (15) | 0.0672 (14) | 0.0408 (10) | −0.0003 (13) | 0.0186 (11) | −0.0031 (10) |
| C18 | 0.0519 (12) | 0.0616 (13) | 0.0457 (10) | 0.0102 (11) | −0.0151 (10) | −0.0155 (9) |
| C19 | 0.0326 (9) | 0.0346 (8) | 0.0372 (9) | 0.0050 (7) | 0.0003 (7) | 0.0027 (7) |
| C20 | 0.0296 (9) | 0.0433 (9) | 0.0370 (8) | 0.0018 (8) | −0.0030 (7) | 0.0037 (8) |
| C21 | 0.0350 (9) | 0.0441 (9) | 0.0403 (9) | 0.0059 (8) | −0.0006 (8) | −0.0020 (8) |
| C22 | 0.0493 (12) | 0.0492 (11) | 0.0449 (10) | 0.0089 (9) | 0.0036 (9) | −0.0088 (9) |
| C23 | 0.0730 (16) | 0.0523 (13) | 0.0527 (12) | −0.0053 (12) | 0.0027 (12) | −0.0173 (10) |
| C1—O1 | 1.377 (3) | C13—C14 | 1.587 (2) |
| C1—C6 | 1.390 (3) | C13—H13 | 0.9800 |
| C1—C2 | 1.394 (3) | C14—O3 | 1.413 (2) |
| C2—C3 | 1.383 (3) | C14—C19 | 1.500 (2) |
| C2—H2 | 0.9300 | C14—C15 | 1.542 (2) |
| C3—C4 | 1.400 (3) | C15—O2 | 1.468 (2) |
| C3—H3 | 0.9300 | C15—H15 | 0.9800 |
| C4—C5 | 1.383 (2) | C16—O4 | 1.199 (2) |
| C4—C8 | 1.505 (3) | C16—O5 | 1.332 (2) |
| C5—C6 | 1.373 (3) | C17—O5 | 1.446 (2) |
| C5—C11 | 1.499 (2) | C17—H17A | 0.9600 |
| C6—O2 | 1.373 (2) | C17—H17B | 0.9600 |
| C7—O1 | 1.412 (3) | C17—H17C | 0.9600 |
| C7—H7A | 0.9600 | C18—O3 | 1.427 (2) |
| C7—H7B | 0.9600 | C18—H18A | 0.9600 |
| C7—H7C | 0.9600 | C18—H18B | 0.9600 |
| C8—C9 | 1.565 (3) | C18—H18C | 0.9600 |
| C8—H8A | 0.9700 | C19—C20 | 1.322 (3) |
| C8—H8B | 0.9700 | C19—H19 | 0.9300 |
| C9—N1 | 1.470 (3) | C20—H20 | 0.9300 |
| C9—C10 | 1.539 (2) | C21—C22 | 1.519 (3) |
| C9—H9 | 0.9800 | C21—H21A | 0.9700 |
| C10—C20 | 1.517 (2) | C21—H21B | 0.9700 |
| C10—C12 | 1.537 (2) | C22—N1 | 1.457 (3) |
| C10—C11 | 1.549 (3) | C22—H22A | 0.9700 |
| C11—C21 | 1.530 (2) | C22—H22B | 0.9700 |
| C11—C15 | 1.545 (2) | C23—N1 | 1.458 (3) |
| C12—C13 | 1.546 (2) | C23—H23A | 0.9600 |
| C12—H12A | 0.9700 | C23—H23B | 0.9600 |
| C12—H12B | 0.9700 | C23—H23C | 0.9600 |
| C13—C16 | 1.514 (2) | ||
| O1—C1—C6 | 125.05 (18) | C14—C13—H13 | 109.3 |
| O1—C1—C2 | 118.06 (18) | O3—C14—C19 | 107.84 (14) |
| C6—C1—C2 | 116.58 (19) | O3—C14—C15 | 114.23 (15) |
| C3—C2—C1 | 122.32 (18) | C19—C14—C15 | 109.89 (13) |
| C3—C2—H2 | 118.8 | O3—C14—C13 | 113.10 (13) |
| C1—C2—H2 | 118.8 | C19—C14—C13 | 107.12 (15) |
| C2—C3—C4 | 120.79 (18) | C15—C14—C13 | 104.43 (13) |
| C2—C3—H3 | 119.6 | O2—C15—C14 | 112.14 (13) |
| C4—C3—H3 | 119.6 | O2—C15—C11 | 107.22 (13) |
| C5—C4—C3 | 115.65 (19) | C14—C15—C11 | 108.33 (14) |
| C5—C4—C8 | 118.90 (16) | O2—C15—H15 | 109.7 |
| C3—C4—C8 | 124.56 (17) | C14—C15—H15 | 109.7 |
| C6—C5—C4 | 123.50 (17) | C11—C15—H15 | 109.7 |
| C6—C5—C11 | 109.92 (15) | O4—C16—O5 | 123.30 (18) |
| C4—C5—C11 | 124.16 (17) | O4—C16—C13 | 124.74 (17) |
| O2—C6—C5 | 113.03 (16) | O5—C16—C13 | 111.95 (16) |
| O2—C6—C1 | 126.25 (18) | O5—C17—H17A | 109.5 |
| C5—C6—C1 | 120.22 (17) | O5—C17—H17B | 109.5 |
| O1—C7—H7A | 109.5 | H17A—C17—H17B | 109.5 |
| O1—C7—H7B | 109.5 | O5—C17—H17C | 109.5 |
| H7A—C7—H7B | 109.5 | H17A—C17—H17C | 109.5 |
| O1—C7—H7C | 109.5 | H17B—C17—H17C | 109.5 |
| H7A—C7—H7C | 109.5 | O3—C18—H18A | 109.5 |
| H7B—C7—H7C | 109.5 | O3—C18—H18B | 109.5 |
| C4—C8—C9 | 115.59 (15) | H18A—C18—H18B | 109.5 |
| C4—C8—H8A | 108.4 | O3—C18—H18C | 109.5 |
| C9—C8—H8A | 108.4 | H18A—C18—H18C | 109.5 |
| C4—C8—H8B | 108.4 | H18B—C18—H18C | 109.5 |
| C9—C8—H8B | 108.4 | C20—C19—C14 | 115.44 (16) |
| H8A—C8—H8B | 107.4 | C20—C19—H19 | 122.3 |
| N1—C9—C10 | 108.61 (15) | C14—C19—H19 | 122.3 |
| N1—C9—C8 | 114.22 (17) | C19—C20—C10 | 114.87 (16) |
| C10—C9—C8 | 111.27 (15) | C19—C20—H20 | 122.6 |
| N1—C9—H9 | 107.5 | C10—C20—H20 | 122.6 |
| C10—C9—H9 | 107.5 | C22—C21—C11 | 112.26 (16) |
| C8—C9—H9 | 107.5 | C22—C21—H21A | 109.2 |
| C20—C10—C12 | 105.24 (14) | C11—C21—H21A | 109.2 |
| C20—C10—C9 | 114.03 (15) | C22—C21—H21B | 109.2 |
| C12—C10—C9 | 115.75 (15) | C11—C21—H21B | 109.2 |
| C20—C10—C11 | 107.15 (14) | H21A—C21—H21B | 107.9 |
| C12—C10—C11 | 108.81 (15) | N1—C22—C21 | 110.23 (17) |
| C9—C10—C11 | 105.52 (15) | N1—C22—H22A | 109.6 |
| C5—C11—C21 | 114.36 (15) | C21—C22—H22A | 109.6 |
| C5—C11—C15 | 101.29 (14) | N1—C22—H22B | 109.6 |
| C21—C11—C15 | 112.32 (14) | C21—C22—H22B | 109.6 |
| C5—C11—C10 | 105.56 (14) | H22A—C22—H22B | 108.1 |
| C21—C11—C10 | 111.03 (15) | N1—C23—H23A | 109.5 |
| C15—C11—C10 | 111.77 (14) | N1—C23—H23B | 109.5 |
| C10—C12—C13 | 109.52 (14) | H23A—C23—H23B | 109.5 |
| C10—C12—H12A | 109.8 | N1—C23—H23C | 109.5 |
| C13—C12—H12A | 109.8 | H23A—C23—H23C | 109.5 |
| C10—C12—H12B | 109.8 | H23B—C23—H23C | 109.5 |
| C13—C12—H12B | 109.8 | C22—N1—C23 | 111.90 (18) |
| H12A—C12—H12B | 108.2 | C22—N1—C9 | 112.11 (17) |
| C16—C13—C12 | 111.21 (16) | C23—N1—C9 | 112.95 (17) |
| C16—C13—C14 | 107.99 (14) | C1—O1—C7 | 116.17 (18) |
| C12—C13—C14 | 109.82 (13) | C6—O2—C15 | 107.29 (14) |
| C16—C13—H13 | 109.3 | C14—O3—C18 | 116.21 (15) |
| C12—C13—H13 | 109.3 | C16—O5—C17 | 115.13 (17) |
| O1—C1—C2—C3 | −171.3 (2) | C16—C13—C14—C19 | −72.07 (17) |
| C6—C1—C2—C3 | 2.5 (3) | C12—C13—C14—C19 | 49.36 (19) |
| C1—C2—C3—C4 | −3.8 (4) | C16—C13—C14—C15 | 171.38 (14) |
| C2—C3—C4—C5 | −2.2 (3) | C12—C13—C14—C15 | −67.18 (17) |
| C2—C3—C4—C8 | 166.8 (2) | O3—C14—C15—O2 | −55.46 (18) |
| C3—C4—C5—C6 | 10.0 (3) | C19—C14—C15—O2 | 65.87 (18) |
| C8—C4—C5—C6 | −159.66 (19) | C13—C14—C15—O2 | −179.52 (13) |
| C3—C4—C5—C11 | 170.57 (18) | O3—C14—C15—C11 | −173.59 (13) |
| C8—C4—C5—C11 | 0.9 (3) | C19—C14—C15—C11 | −52.26 (18) |
| C4—C5—C6—O2 | 160.73 (17) | C13—C14—C15—C11 | 62.35 (16) |
| C11—C5—C6—O2 | −2.2 (2) | C5—C11—C15—O2 | −10.94 (17) |
| C4—C5—C6—C1 | −11.7 (3) | C21—C11—C15—O2 | 111.52 (16) |
| C11—C5—C6—C1 | −174.64 (17) | C10—C11—C15—O2 | −122.92 (14) |
| O1—C1—C6—O2 | 6.9 (3) | C5—C11—C15—C14 | 110.28 (15) |
| C2—C1—C6—O2 | −166.41 (19) | C21—C11—C15—C14 | −127.26 (15) |
| O1—C1—C6—C5 | 178.25 (19) | C10—C11—C15—C14 | −1.70 (18) |
| C2—C1—C6—C5 | 4.9 (3) | C12—C13—C16—O4 | −37.8 (3) |
| C5—C4—C8—C9 | 6.1 (3) | C14—C13—C16—O4 | 82.8 (2) |
| C3—C4—C8—C9 | −162.6 (2) | C12—C13—C16—O5 | 142.17 (16) |
| C4—C8—C9—N1 | −97.5 (2) | C14—C13—C16—O5 | −97.26 (17) |
| C4—C8—C9—C10 | 25.9 (3) | O3—C14—C19—C20 | −178.76 (16) |
| N1—C9—C10—C20 | −178.89 (16) | C15—C14—C19—C20 | 56.2 (2) |
| C8—C9—C10—C20 | 54.6 (2) | C13—C14—C19—C20 | −56.72 (19) |
| N1—C9—C10—C12 | −56.6 (2) | C14—C19—C20—C10 | 1.0 (2) |
| C8—C9—C10—C12 | 176.87 (18) | C12—C10—C20—C19 | 59.6 (2) |
| N1—C9—C10—C11 | 63.79 (18) | C9—C10—C20—C19 | −172.53 (17) |
| C8—C9—C10—C11 | −62.8 (2) | C11—C10—C20—C19 | −56.2 (2) |
| C6—C5—C11—C21 | −112.91 (18) | C5—C11—C21—C22 | −66.6 (2) |
| C4—C5—C11—C21 | 84.3 (2) | C15—C11—C21—C22 | 178.70 (16) |
| C6—C5—C11—C15 | 8.13 (19) | C10—C11—C21—C22 | 52.7 (2) |
| C4—C5—C11—C15 | −154.69 (18) | C11—C21—C22—N1 | −50.8 (2) |
| C6—C5—C11—C10 | 124.75 (16) | C21—C22—N1—C23 | −173.61 (17) |
| C4—C5—C11—C10 | −38.1 (2) | C21—C22—N1—C9 | 58.3 (2) |
| C20—C10—C11—C5 | −55.15 (18) | C10—C9—N1—C22 | −66.6 (2) |
| C12—C10—C11—C5 | −168.46 (14) | C8—C9—N1—C22 | 58.2 (2) |
| C9—C10—C11—C5 | 66.73 (17) | C10—C9—N1—C23 | 165.85 (17) |
| C20—C10—C11—C21 | −179.60 (13) | C8—C9—N1—C23 | −69.3 (2) |
| C12—C10—C11—C21 | 67.09 (18) | C6—C1—O1—C7 | 45.0 (3) |
| C9—C10—C11—C21 | −57.73 (18) | C2—C1—O1—C7 | −141.8 (2) |
| C20—C10—C11—C15 | 54.12 (18) | C5—C6—O2—C15 | −5.3 (2) |
| C12—C10—C11—C15 | −59.19 (17) | C1—C6—O2—C15 | 166.61 (18) |
| C9—C10—C11—C15 | 175.99 (14) | C14—C15—O2—C6 | −108.49 (15) |
| C20—C10—C12—C13 | −60.31 (19) | C11—C15—O2—C6 | 10.29 (18) |
| C9—C10—C12—C13 | 172.82 (16) | C19—C14—O3—C18 | −168.91 (17) |
| C11—C10—C12—C13 | 54.25 (19) | C15—C14—O3—C18 | −46.5 (2) |
| C10—C12—C13—C16 | 126.85 (16) | C13—C14—O3—C18 | 72.8 (2) |
| C10—C12—C13—C14 | 7.4 (2) | O4—C16—O5—C17 | 0.6 (3) |
| C16—C13—C14—O3 | 46.6 (2) | C13—C16—O5—C17 | −179.37 (16) |
| C12—C13—C14—O3 | 168.04 (15) |
| H··· | ||||
| C7—H7A···O2 | 0.96 | 2.34 | 3.002 (3) | 125 |
| C12—H12B···O4 | 0.97 | 2.46 | 2.899 (2) | 107 |
| C15—H15···O4i | 0.98 | 2.53 | 3.483 (2) | 165 |
| C17—H17C···O2ii | 0.96 | 2.62 | 3.533 (3) | 158 |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| C7—H7 | 0.96 | 2.34 | 3.002 (3) | 125 |
| C12—H12 | 0.97 | 2.46 | 2.899 (2) | 107 |
| C15—H15⋯O4i | 0.98 | 2.53 | 3.483 (2) | 165 |
| C17—H17 | 0.96 | 2.62 | 3.533 (3) | 158 |
Symmetry codes: (i) ; (ii) .