N1—H71 | 0.9448 (11) | C16—H16 | 0.95 |
N1—C3 | 1.5141 (19) | C21—C22 | 1.388 (2) |
N1—C4 | 1.492 (2) | C21—C26 | 1.3962 (19) |
N1—C7 | 1.5036 (18) | C22—H22 | 0.95 |
N2—C5 | 1.4718 (17) | C22—C23 | 1.395 (3) |
N2—C6 | 1.4682 (19) | C23—H23 | 0.95 |
N2—C8 | 1.4848 (17) | C23—C24 | 1.383 (2) |
C1—H1a | 0.95 | C24—H24 | 0.95 |
C1—C2 | 1.317 (2) | C24—C25 | 1.375 (3) |
C1—C11 | 1.474 (2) | C25—H25 | 0.95 |
C2—H2 | 0.95 | C25—C26 | 1.392 (2) |
C2—C3 | 1.494 (2) | C26—H26 | 0.95 |
C3—H3a | 0.99 | C31—C32 | 1.393 (2) |
C3—H3b | 0.99 | C31—C36 | 1.3867 (19) |
H3a—H3b | 1.5869 | C32—H32 | 0.95 |
C4—H4a | 0.99 | C32—C33 | 1.389 (2) |
C4—H4b | 0.99 | C33—H33 | 0.95 |
C4—C5 | 1.511 (2) | C33—C34 | 1.370 (2) |
H4a—H4b | 1.6058 | C34—H34 | 0.95 |
C5—H5a | 0.99 | C34—C35 | 1.386 (3) |
C5—H5b | 0.99 | C35—H35 | 0.95 |
H5a—H5b | 1.6091 | C35—C36 | 1.387 (2) |
C6—H6a | 0.99 | C36—H36 | 0.95 |
C6—H6b | 0.99 | O1—C41 | 1.2810 (17) |
C6—C7 | 1.512 (2) | O2—N3 | 1.2281 (18) |
H6a—H6b | 1.6016 | O3—N3 | 1.215 (2) |
C7—H7a | 0.99 | O4—N4 | 1.227 (2) |
C7—H7b | 0.99 | O5—N4 | 1.224 (2) |
H7a—H7b | 1.6014 | O6—C9 | 1.201 (2) |
C8—H8 | 1 | O7—C9 | 1.319 (2) |
C8—C21 | 1.522 (2) | O7—H7 | 0.9238 (15) |
C8—C31 | 1.5282 (19) | N3—C46 | 1.456 (2) |
C11—C12 | 1.396 (2) | N4—C44 | 1.453 (2) |
C11—C16 | 1.399 (3) | C9—C42 | 1.512 (3) |
C12—H12 | 0.95 | C41—C42 | 1.444 (2) |
C12—C13 | 1.390 (2) | C41—C46 | 1.430 (2) |
C13—H13 | 0.95 | C42—C43 | 1.367 (2) |
C13—C14 | 1.372 (3) | C43—H43 | 0.95 |
C14—H14 | 0.95 | C43—C44 | 1.379 (2) |
C14—C15 | 1.382 (3) | C44—C45 | 1.378 (2) |
C15—H15 | 0.95 | C45—H45 | 0.95 |
C15—C16 | 1.390 (3) | C45—C46 | 1.380 (2) |
H71—N1—C3 | 109.70 (10) | C15—C16—H16 | 119.61 |
H71—N1—C4 | 107.37 (11) | C8—C21—C22 | 118.95 (12) |
H71—N1—C7 | 106.90 (11) | C8—C21—C26 | 122.30 (13) |
C3—N1—C4 | 112.27 (12) | C22—C21—C26 | 118.75 (14) |
C3—N1—C7 | 110.59 (11) | C21—C22—H22 | 119.72 |
C4—N1—C7 | 109.82 (10) | C21—C22—C23 | 120.56 (14) |
C5—N2—C6 | 107.42 (10) | H22—C22—C23 | 119.72 |
C5—N2—C8 | 110.41 (11) | C22—C23—H23 | 119.9 |
C6—N2—C8 | 110.71 (11) | C22—C23—C24 | 120.20 (16) |
H1a—C1—C2 | 116.52 | H23—C23—C24 | 119.9 |
H1a—C1—C11 | 116.52 | C23—C24—H24 | 120.2 |
C2—C1—C11 | 126.96 (14) | C23—C24—C25 | 119.60 (17) |
C1—C2—H2 | 118.03 | H24—C24—C25 | 120.2 |
C1—C2—C3 | 123.95 (13) | C24—C25—H25 | 119.64 |
H2—C2—C3 | 118.03 | C24—C25—C26 | 120.72 (15) |
N1—C3—C2 | 112.26 (13) | H25—C25—C26 | 119.64 |
N1—C3—H3a | 109.47 | C21—C26—C25 | 120.16 (14) |
N1—C3—H3b | 109.47 | C21—C26—H26 | 119.92 |
C2—C3—H3a | 109.47 | C25—C26—H26 | 119.92 |
C2—C3—H3b | 109.47 | C8—C31—C32 | 119.98 (11) |
H3a—C3—H3b | 106.54 | C8—C31—C36 | 121.61 (13) |
N1—C4—H4a | 109.47 | C32—C31—C36 | 118.41 (13) |
N1—C4—H4b | 109.47 | C31—C32—H32 | 119.64 |
N1—C4—C5 | 110.53 (12) | C31—C32—C33 | 120.73 (13) |
H4a—C4—H4b | 108.39 | H32—C32—C33 | 119.64 |
H4a—C4—C5 | 109.47 | C32—C33—H33 | 119.85 |
H4b—C4—C5 | 109.47 | C32—C33—C34 | 120.30 (16) |
N2—C5—C4 | 110.21 (12) | H33—C33—C34 | 119.85 |
N2—C5—H5a | 109.47 | C33—C34—H34 | 120.18 |
N2—C5—H5b | 109.47 | C33—C34—C35 | 119.65 (15) |
C4—C5—H5a | 109.47 | H34—C34—C35 | 120.18 |
C4—C5—H5b | 109.47 | C34—C35—H35 | 119.87 |
H5a—C5—H5b | 108.72 | C34—C35—C36 | 120.25 (14) |
N2—C6—H6a | 109.47 | H35—C35—C36 | 119.88 |
N2—C6—H6b | 109.47 | C31—C36—C35 | 120.65 (15) |
N2—C6—C7 | 110.93 (12) | C31—C36—H36 | 119.67 |
H6a—C6—H6b | 107.97 | C35—C36—H36 | 119.68 |
H6a—C6—C7 | 109.47 | C41—O1—H7 | 101.64 (10) |
H6b—C6—C7 | 109.47 | C9—O7—H7 | 112.68 (16) |
N1—C7—C6 | 110.95 (12) | O2—N3—O3 | 123.16 (15) |
N1—C7—H7a | 109.47 | O2—N3—C46 | 118.72 (15) |
N1—C7—H7b | 109.47 | O3—N3—C46 | 118.10 (13) |
C6—C7—H7a | 109.47 | O4—N4—O5 | 122.91 (15) |
C6—C7—H7b | 109.47 | O4—N4—C44 | 118.79 (14) |
H7a—C7—H7b | 107.95 | O5—N4—C44 | 118.29 (16) |
N2—C8—H8 | 108.39 | O6—C9—O7 | 122.64 (19) |
N2—C8—C21 | 111.04 (11) | O6—C9—C42 | 122.44 (16) |
N2—C8—C31 | 110.45 (11) | O7—C9—C42 | 114.91 (15) |
H8—C8—C21 | 107.41 | O1—C41—C42 | 120.00 (15) |
H8—C8—C31 | 108.03 | O1—C41—C46 | 125.00 (14) |
C21—C8—C31 | 111.38 (10) | C42—C41—C46 | 115.00 (13) |
C1—C11—C12 | 122.33 (15) | C9—C42—C41 | 121.64 (14) |
C1—C11—C16 | 119.24 (13) | C9—C42—C43 | 116.80 (14) |
C12—C11—C16 | 118.42 (15) | C41—C42—C43 | 121.55 (16) |
C11—C12—H12 | 119.81 | C42—C43—H43 | 119.87 |
C11—C12—C13 | 120.37 (17) | C42—C43—C44 | 120.27 (14) |
H12—C12—C13 | 119.81 | H43—C43—C44 | 119.87 |
C12—C13—H13 | 119.82 | N4—C44—C43 | 120.01 (14) |
C12—C13—C14 | 120.37 (17) | N4—C44—C45 | 118.40 (15) |
H13—C13—C14 | 119.82 | C43—C44—C45 | 121.59 (13) |
C13—C14—H14 | 119.8 | C44—C45—H45 | 120.57 |
C13—C14—C15 | 120.40 (18) | C44—C45—C46 | 118.86 (15) |
H14—C14—C15 | 119.8 | H45—C45—C46 | 120.57 |
C14—C15—H15 | 120.17 | N3—C46—C41 | 120.55 (13) |
C14—C15—C16 | 119.7 (2) | N3—C46—C45 | 116.73 (14) |
H15—C15—C16 | 120.17 | C41—C46—C45 | 122.71 (13) |
C11—C16—C15 | 120.77 (16) | O1—H7—O7 | 148.96 (9) |
C11—C16—H16 | 119.61 |