S1—O3 | 1.4219 (18) | C6—H6A | 0.9700 |
S1—O2 | 1.4220 (17) | C6—H6B | 0.9700 |
S1—O1 | 1.5796 (10) | C5—H5A | 0.9700 |
S1—C14 | 1.7510 (16) | C5—H5B | 0.9700 |
O1—C1 | 1.469 (2) | C8—C9 | 1.392 (3) |
C14—C19 | 1.379 (3) | C8—H8 | 0.9300 |
C14—C15 | 1.392 (3) | C19—C18 | 1.380 (4) |
C2—C1 | 1.505 (2) | C19—H19 | 0.9300 |
C2—C6 | 1.527 (3) | C9—C10 | 1.362 (4) |
C2—C3 | 1.542 (2) | C9—H9 | 0.9300 |
C2—H2 | 0.9800 | C17—C16 | 1.374 (4) |
N1—C5 | 1.454 (3) | C17—C18 | 1.375 (4) |
N1—C6 | 1.456 (2) | C17—C20 | 1.519 (3) |
N1—C13 | 1.474 (3) | C18—H18 | 0.9300 |
C3—C7 | 1.513 (3) | C20—H20A | 0.9600 |
C3—C4 | 1.535 (2) | C20—H20B | 0.9600 |
C3—H3 | 0.9800 | C20—H20C | 0.9600 |
C7—C8 | 1.387 (3) | F1—C10 | 1.368 (3) |
C7—C12 | 1.392 (3) | C13—H13A | 0.9600 |
C4—C5 | 1.501 (3) | C13—H13B | 0.9600 |
C4—H4A | 0.9700 | C13—H13C | 0.9600 |
C4—H4B | 0.9700 | C12—C11 | 1.380 (3) |
C1—H1A | 0.9700 | C12—H12 | 0.9300 |
C1—H1B | 0.9700 | C10—C11 | 1.356 (4) |
C15—C16 | 1.375 (3) | C16—H16 | 0.9300 |
C15—H15 | 0.9300 | C11—H11 | 0.9300 |
O3—S1—O2 | 119.85 (9) | C2—C6—H6B | 109.3 |
O3—S1—O1 | 109.40 (9) | H6A—C6—H6B | 108.0 |
O2—S1—O1 | 103.91 (9) | N1—C5—C4 | 111.70 (17) |
O3—S1—C14 | 108.92 (10) | N1—C5—H5A | 109.3 |
O2—S1—C14 | 109.32 (12) | C4—C5—H5A | 109.3 |
O1—S1—C14 | 104.29 (6) | N1—C5—H5B | 109.3 |
C1—O1—S1 | 117.67 (11) | C4—C5—H5B | 109.3 |
C19—C14—C15 | 120.08 (17) | H5A—C5—H5B | 107.9 |
C19—C14—S1 | 120.46 (16) | C7—C8—C9 | 121.4 (2) |
C15—C14—S1 | 119.45 (17) | C7—C8—H8 | 119.3 |
C1—C2—C6 | 111.55 (15) | C9—C8—H8 | 119.3 |
C1—C2—C3 | 113.27 (14) | C14—C19—C18 | 119.3 (2) |
C6—C2—C3 | 111.54 (15) | C14—C19—H19 | 120.4 |
C1—C2—H2 | 106.7 | C18—C19—H19 | 120.4 |
C6—C2—H2 | 106.7 | C10—C9—C8 | 118.5 (2) |
C3—C2—H2 | 106.7 | C10—C9—H9 | 120.8 |
C5—N1—C6 | 109.66 (15) | C8—C9—H9 | 120.8 |
C5—N1—C13 | 110.76 (19) | C16—C17—C18 | 117.99 (19) |
C6—N1—C13 | 109.76 (18) | C16—C17—C20 | 121.4 (3) |
C7—C3—C4 | 113.49 (15) | C18—C17—C20 | 120.6 (4) |
C7—C3—C2 | 110.99 (14) | C17—C18—C19 | 121.7 (2) |
C4—C3—C2 | 109.40 (15) | C17—C18—H18 | 119.2 |
C7—C3—H3 | 107.6 | C19—C18—H18 | 119.2 |
C4—C3—H3 | 107.6 | C17—C20—H20A | 109.5 |
C2—C3—H3 | 107.6 | C17—C20—H20B | 109.5 |
C8—C7—C12 | 117.4 (2) | H20A—C20—H20B | 109.5 |
C8—C7—C3 | 121.21 (18) | C17—C20—H20C | 109.5 |
C12—C7—C3 | 121.27 (18) | H20A—C20—H20C | 109.5 |
C5—C4—C3 | 112.10 (16) | H20B—C20—H20C | 109.5 |
C5—C4—H4A | 109.2 | N1—C13—H13A | 109.5 |
C3—C4—H4A | 109.2 | N1—C13—H13B | 109.5 |
C5—C4—H4B | 109.2 | H13A—C13—H13B | 109.5 |
C3—C4—H4B | 109.2 | N1—C13—H13C | 109.5 |
H4A—C4—H4B | 107.9 | H13A—C13—H13C | 109.5 |
O1—C1—C2 | 108.42 (13) | H13B—C13—H13C | 109.5 |
O1—C1—H1A | 110.0 | C11—C12—C7 | 121.4 (2) |
C2—C1—H1A | 110.0 | C11—C12—H12 | 119.3 |
O1—C1—H1B | 110.0 | C7—C12—H12 | 119.3 |
C2—C1—H1B | 110.0 | C11—C10—C9 | 122.2 (2) |
H1A—C1—H1B | 108.4 | C11—C10—F1 | 118.5 (3) |
C16—C15—C14 | 118.8 (2) | C9—C10—F1 | 119.3 (3) |
C16—C15—H15 | 120.6 | C17—C16—C15 | 122.2 (2) |
C14—C15—H15 | 120.6 | C17—C16—H16 | 118.9 |
N1—C6—C2 | 111.50 (16) | C15—C16—H16 | 118.9 |
N1—C6—H6A | 109.3 | C10—C11—C12 | 119.1 (2) |
C2—C6—H6A | 109.3 | C10—C11—H11 | 120.4 |
N1—C6—H6B | 109.3 | C12—C11—H11 | 120.4 |
O3—S1—O1—C1 | −38.54 (14) | C13—N1—C6—C2 | 177.1 (2) |
O2—S1—O1—C1 | −167.66 (14) | C1—C2—C6—N1 | −176.31 (15) |
C14—S1—O1—C1 | 77.84 (14) | C3—C2—C6—N1 | 55.9 (2) |
O3—S1—C14—C19 | −161.67 (15) | C6—N1—C5—C4 | 61.7 (2) |
O2—S1—C14—C19 | −29.00 (16) | C13—N1—C5—C4 | −177.04 (18) |
O1—S1—C14—C19 | 81.61 (16) | C3—C4—C5—N1 | −57.2 (2) |
O3—S1—C14—C15 | 17.09 (17) | C12—C7—C8—C9 | −0.8 (3) |
O2—S1—C14—C15 | 149.76 (15) | C3—C7—C8—C9 | 175.15 (18) |
O1—S1—C14—C15 | −99.62 (15) | C15—C14—C19—C18 | −0.3 (3) |
C1—C2—C3—C7 | 57.92 (18) | S1—C14—C19—C18 | 178.51 (16) |
C6—C2—C3—C7 | −175.24 (14) | C7—C8—C9—C10 | −0.4 (3) |
C1—C2—C3—C4 | −176.09 (16) | C16—C17—C18—C19 | 1.1 (3) |
C6—C2—C3—C4 | −49.2 (2) | C20—C17—C18—C19 | −178.8 (2) |
C4—C3—C7—C8 | 129.5 (2) | C14—C19—C18—C17 | −0.2 (3) |
C2—C3—C7—C8 | −106.83 (19) | C8—C7—C12—C11 | 1.1 (3) |
C4—C3—C7—C12 | −54.7 (2) | C3—C7—C12—C11 | −174.8 (2) |
C2—C3—C7—C12 | 68.9 (2) | C8—C9—C10—C11 | 1.3 (4) |
C7—C3—C4—C5 | 174.59 (17) | C8—C9—C10—F1 | −177.8 (2) |
C2—C3—C4—C5 | 50.0 (2) | C18—C17—C16—C15 | −1.7 (3) |
S1—O1—C1—C2 | −178.87 (11) | C20—C17—C16—C15 | 178.3 (2) |
C6—C2—C1—O1 | −61.63 (18) | C14—C15—C16—C17 | 1.3 (3) |
C3—C2—C1—O1 | 65.21 (18) | C9—C10—C11—C12 | −1.1 (4) |
C19—C14—C15—C16 | −0.3 (3) | F1—C10—C11—C12 | 178.1 (2) |
S1—C14—C15—C16 | −179.04 (15) | C7—C12—C11—C10 | −0.2 (4) |
C5—N1—C6—C2 | −61.0 (2) |