66X
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | N2 | sing | 1.47Å | 1.47Å | |
N2 | C3 | sing | 1.38Å | 1.39Å | |
C3 | N4 | doub | 1.32Å | 1.33Å | Aromatic |
C3 | N8 | sing | 1.32Å | 1.33Å | Aromatic |
N4 | C5 | sing | 1.33Å | 1.33Å | Aromatic |
N8 | C7 | doub | 1.33Å | 1.33Å | Aromatic |
C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
C7 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
C7 | N9 | sing | 1.38Å | 1.38Å | |
C10 | N9 | sing | 1.49Å | 1.47Å | |
C10 | C11 | sing | 1.55Å | 1.54Å | |
N9 | C14 | sing | 1.48Å | 1.46Å | |
C11 | C12 | sing | 1.55Å | 1.55Å | |
C14 | C12 | sing | 1.54Å | 1.53Å | |
C12 | N15 | sing | 1.47Å | 1.47Å | |
N15 | C16 | sing | 1.35Å | 1.35Å | |
O17 | C16 | doub | 1.22Å | 1.23Å | |
C16 | N18 | sing | 1.35Å | 1.37Å | |
N18 | C19 | sing | 1.40Å | 1.42Å | |
C19 | C31 | doub | 1.39Å | 1.40Å | Aromatic |
C19 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
C31 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
F33 | C32 | sing | 1.40Å | 1.40Å | |
C30 | C32 | sing | 1.51Å | 1.52Å | |
C30 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
F34 | C32 | sing | 1.40Å | 1.40Å | |
C32 | F35 | sing | 1.40Å | 1.40Å | |
C21 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
C22 | C23 | sing | 1.51Å | 1.52Å | |
C23 | N24 | sing | 1.47Å | 1.47Å | |
N24 | C25 | sing | 1.47Å | 1.48Å | |
N24 | C29 | sing | 1.47Å | 1.48Å | |
C25 | C26 | sing | 1.53Å | 1.54Å | |
C29 | C28 | sing | 1.53Å | 1.53Å | |
C26 | O27 | sing | 1.43Å | 1.43Å | |
C28 | O27 | sing | 1.43Å | 1.43Å | |
C14 | H1 | sing | 1.09Å | 1.10Å | |
C14 | H2 | sing | 1.09Å | 1.10Å | |
C5 | H3 | sing | 1.08Å | 1.08Å | |
C6 | H4 | sing | 1.08Å | 1.08Å | |
C11 | H5 | sing | 1.09Å | 1.10Å | |
C11 | H6 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C10 | H8 | sing | 1.09Å | 1.10Å | |
C12 | H9 | sing | 1.09Å | 1.10Å | |
N2 | H10 | sing | 0.97Å | 1.00Å | |
C1 | H11 | sing | 1.09Å | 1.10Å | |
C1 | H12 | sing | 1.09Å | 1.10Å | |
C1 | H13 | sing | 1.09Å | 1.10Å | |
N15 | H14 | sing | 0.97Å | 1.00Å | |
N18 | H15 | sing | 0.97Å | 1.00Å | |
C20 | H16 | sing | 1.08Å | 1.08Å | |
C21 | H17 | sing | 1.08Å | 1.08Å | |
C23 | H18 | sing | 1.09Å | 1.10Å | |
C23 | H19 | sing | 1.09Å | 1.10Å | |
C25 | H21 | sing | 1.09Å | 1.10Å | |
C25 | H22 | sing | 1.09Å | 1.10Å | |
C26 | H23 | sing | 1.09Å | 1.10Å | |
C26 | H24 | sing | 1.09Å | 1.10Å | |
C28 | H25 | sing | 1.09Å | 1.10Å | |
C28 | H26 | sing | 1.09Å | 1.10Å | |
C29 | H27 | sing | 1.09Å | 1.10Å | |
C29 | H28 | sing | 1.09Å | 1.10Å | |
C31 | H29 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C1 | N2 | C3 | 121.1° | 120.0° |
C1 | N2 | H10 | 106.5° | 120.0° |
N2 | C1 | H11 | 109.5° | 109.4° |
N2 | C1 | H12 | 109.5° | 109.5° |
N2 | C1 | H13 | 109.5° | 109.5° |
N2 | C3 | N4 | 119.8° | 119.2° |
N2 | C3 | N8 | 119.2° | 119.1° |
C3 | N2 | H10 | 106.5° | 120.1° |
N4 | C3 | N8 | 120.9° | 121.7° |
C3 | N4 | C5 | 120.9° | 120.9° |
C3 | N8 | C7 | 121.6° | 120.6° |
N4 | C5 | C6 | 119.7° | 119.2° |
N4 | C5 | H3 | 120.1° | 120.4° |
N8 | C7 | C6 | 118.9° | 119.0° |
N8 | C7 | N9 | 119.0° | 120.5° |
C5 | C6 | C7 | 118.1° | 118.5° |
C6 | C5 | H3 | 120.1° | 120.3° |
C5 | C6 | H4 | 121.0° | 120.7° |
C6 | C7 | N9 | 122.1° | 120.5° |
C7 | C6 | H4 | 121.0° | 120.8° |
C7 | N9 | C10 | 125.9° | 111.0° |
C7 | N9 | C14 | 125.4° | 111.0° |
N9 | C10 | C11 | 105.3° | 103.2° |
C10 | N9 | C14 | 108.7° | 105.8° |
N9 | C10 | H7 | 110.5° | 110.7° |
N9 | C10 | H8 | 110.5° | 110.7° |
C10 | C11 | C12 | 101.7° | 103.0° |
C10 | C11 | H5 | 111.3° | 110.7° |
C10 | C11 | H6 | 111.4° | 110.9° |
C11 | C10 | H7 | 110.5° | 110.7° |
C11 | C10 | H8 | 110.5° | 110.7° |
N9 | C14 | C12 | 107.3° | 107.1° |
N9 | C14 | H1 | 110.0° | 109.9° |
N9 | C14 | H2 | 110.0° | 110.1° |
C11 | C12 | C14 | 101.3° | 105.1° |
C11 | C12 | N15 | 112.1° | 110.3° |
C12 | C11 | H5 | 111.4° | 110.8° |
C12 | C11 | H6 | 111.4° | 110.7° |
C11 | C12 | H9 | 110.6° | 110.3° |
C14 | C12 | N15 | 109.7° | 110.3° |
C12 | C14 | H1 | 110.0° | 109.9° |
C12 | C14 | H2 | 110.0° | 109.9° |
C14 | C12 | H9 | 110.9° | 110.3° |
C12 | N15 | C16 | 120.0° | 120.0° |
N15 | C12 | H9 | 111.8° | 110.4° |
C12 | N15 | H14 | 120.0° | 120.0° |
N15 | C16 | O17 | 118.7° | 120.0° |
N15 | C16 | N18 | 118.8° | 120.0° |
C16 | N15 | H14 | 120.0° | 120.0° |
O17 | C16 | N18 | 122.6° | 120.0° |
C16 | N18 | C19 | 124.8° | 120.0° |
C16 | N18 | H15 | 117.6° | 120.0° |
N18 | C19 | C31 | 125.4° | 120.1° |
N18 | C19 | C20 | 116.4° | 120.1° |
C19 | N18 | H15 | 117.6° | 120.0° |
C31 | C19 | C20 | 118.2° | 119.9° |
C19 | C31 | C30 | 121.3° | 119.9° |
C19 | C31 | H29 | 119.3° | 120.1° |
C19 | C20 | C21 | 121.0° | 119.9° |
C19 | C20 | H16 | 119.5° | 120.0° |
C31 | C30 | C32 | 119.0° | 119.9° |
C31 | C30 | C22 | 119.6° | 120.1° |
C30 | C31 | H29 | 119.3° | 120.1° |
C20 | C21 | C22 | 121.2° | 120.1° |
C21 | C20 | H16 | 119.5° | 120.0° |
C20 | C21 | H17 | 119.4° | 120.0° |
F33 | C32 | C30 | 112.6° | 109.4° |
F33 | C32 | F34 | 108.3° | 109.4° |
F33 | C32 | F35 | 107.1° | 109.5° |
C32 | C30 | C22 | 121.3° | 119.9° |
C30 | C32 | F34 | 107.1° | 109.5° |
C30 | C32 | F35 | 112.1° | 109.5° |
C30 | C22 | C21 | 118.6° | 120.1° |
C30 | C22 | C23 | 121.8° | 120.0° |
F34 | C32 | F35 | 109.6° | 109.5° |
C21 | C22 | C23 | 119.7° | 119.9° |
C22 | C21 | H17 | 119.4° | 120.0° |
C22 | C23 | N24 | 114.2° | 109.5° |
C22 | C23 | H18 | 108.3° | 109.4° |
C22 | C23 | H19 | 108.3° | 109.5° |
C23 | N24 | C25 | 111.2° | 111.0° |
C23 | N24 | C29 | 110.5° | 111.0° |
N24 | C23 | H18 | 108.3° | 109.5° |
N24 | C23 | H19 | 108.3° | 109.5° |
C25 | N24 | C29 | 112.7° | 110.7° |
N24 | C25 | C26 | 110.6° | 109.3° |
N24 | C25 | H21 | 109.2° | 109.5° |
N24 | C25 | H22 | 109.2° | 109.5° |
N24 | C29 | C28 | 108.3° | 109.3° |
N24 | C29 | H27 | 109.8° | 109.5° |
N24 | C29 | H28 | 109.8° | 109.5° |
C25 | C26 | O27 | 109.4° | 109.2° |
C26 | C25 | H21 | 109.2° | 109.5° |
C26 | C25 | H22 | 109.2° | 109.5° |
C25 | C26 | H23 | 109.5° | 109.5° |
C25 | C26 | H24 | 109.5° | 109.5° |
C29 | C28 | O27 | 107.6° | 109.3° |
C29 | C28 | H25 | 109.9° | 109.5° |
C29 | C28 | H26 | 109.9° | 109.6° |
C28 | C29 | H27 | 109.7° | 109.5° |
C28 | C29 | H28 | 109.8° | 109.5° |
C26 | O27 | C28 | 113.0° | 113.7° |
O27 | C26 | H23 | 109.5° | 109.5° |
O27 | C26 | H24 | 109.5° | 109.5° |
O27 | C28 | H25 | 109.9° | 109.5° |
O27 | C28 | H26 | 109.9° | 109.5° |
H1 | C14 | H2 | 109.5° | 110.0° |
H5 | C11 | H6 | 109.5° | 110.6° |
H7 | C10 | H8 | 109.5° | 110.7° |
H11 | C1 | H12 | 109.5° | 109.5° |
H11 | C1 | H13 | 109.5° | 109.4° |
H12 | C1 | H13 | 109.5° | 109.5° |
H18 | C23 | H19 | 109.5° | 109.5° |
H21 | C25 | H22 | 109.5° | 109.5° |
H23 | C26 | H24 | 109.5° | 109.5° |
H25 | C28 | H26 | 109.5° | 109.4° |
H27 | C29 | H28 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | N2 | C3 | H10 | 121.6° | 180.0° |
C1 | N2 | C3 | N4 | 178.1° | 0.0° |
C1 | N2 | C3 | N8 | 1.7° | 179.4° |
N2 | C1 | H11 | H12 | 120.0° | 120.0° |
N2 | C1 | H11 | H13 | 120.0° | 120.0° |
N2 | C1 | H12 | H13 | 120.0° | 120.0° |
N2 | C3 | N4 | N8 | 179.7° | 179.4° |
N2 | C3 | N4 | C5 | 179.8° | 180.0° |
N2 | C3 | N8 | C7 | 179.9° | 179.7° |
C3 | N2 | C1 | H11 | 180.0° | 180.0° |
C3 | N2 | C1 | H12 | 60.0° | 60.0° |
C3 | N2 | C1 | H13 | 60.0° | 60.1° |
N4 | C3 | N8 | C7 | 0.4° | 0.9° |
C3 | N4 | C5 | C6 | 0.2° | 0.0° |
C3 | N4 | C5 | H3 | 179.8° | 179.7° |
N4 | C3 | N2 | H10 | 56.5° | 180.0° |
N8 | C3 | N4 | C5 | 0.0° | 0.6° |
C3 | N8 | C7 | C6 | 0.5° | 0.6° |
C3 | N8 | C7 | N9 | 178.9° | 179.5° |
N8 | C3 | N2 | H10 | 123.3° | 0.6° |
N4 | C5 | C6 | H3 | 180.0° | 179.8° |
N4 | C5 | C6 | C7 | 0.1° | 0.2° |
N4 | C5 | C6 | H4 | 179.9° | 179.8° |
N8 | C7 | C6 | C5 | 0.2° | 0.0° |
N8 | C7 | C6 | N9 | 178.4° | 179.9° |
N8 | C7 | N9 | C10 | 18.1° | 120.2° |
N8 | C7 | N9 | C14 | 159.4° | 2.8° |
N8 | C7 | C6 | H4 | 179.7° | 179.9° |
C5 | C6 | C7 | H4 | 180.0° | 180.0° |
C5 | C6 | C7 | N9 | 178.7° | 180.0° |
C6 | C7 | N9 | C10 | 163.5° | 59.9° |
C6 | C7 | N9 | C14 | 19.0° | 177.3° |
C7 | C6 | C5 | H3 | 179.9° | 180.0° |
C7 | N9 | C10 | C14 | 177.8° | 120.5° |
C7 | N9 | C10 | C11 | 166.0° | 159.7° |
C7 | N9 | C14 | C12 | 168.6° | 145.8° |
C7 | N9 | C14 | H1 | 49.0° | 94.9° |
C7 | N9 | C14 | H2 | 71.7° | 26.4° |
N9 | C7 | C6 | H4 | 1.3° | 0.0° |
C7 | N9 | C10 | H7 | 46.7° | 41.3° |
C7 | N9 | C10 | H8 | 74.6° | 81.8° |
N9 | C10 | C11 | H7 | 119.3° | 118.4° |
N9 | C10 | C11 | H8 | 119.3° | 118.5° |
N9 | C10 | C11 | C12 | 34.4° | 37.4° |
C10 | N9 | C14 | C12 | 9.2° | 25.3° |
C10 | N9 | C14 | H1 | 128.8° | 144.6° |
C10 | N9 | C14 | H2 | 110.5° | 94.1° |
N9 | C10 | C11 | H5 | 84.4° | 81.0° |
N9 | C10 | C11 | H6 | 153.1° | 155.8° |
N9 | C10 | H7 | H8 | 121.9° | 123.1° |
C11 | C10 | N9 | C14 | 16.1° | 39.2° |
C10 | C11 | C12 | H5 | 118.7° | 118.4° |
C10 | C11 | C12 | H6 | 118.8° | 118.6° |
C10 | C11 | C12 | C14 | 38.6° | 22.0° |
C10 | C11 | C12 | N15 | 155.5° | 140.8° |
C10 | C11 | H5 | H6 | 123.6° | 123.4° |
C11 | C10 | H7 | H8 | 122.0° | 123.1° |
C10 | C11 | C12 | H9 | 79.0° | 96.9° |
N9 | C14 | C12 | C11 | 30.2° | 1.2° |
N9 | C14 | C12 | H1 | 119.7° | 119.4° |
N9 | C14 | C12 | H2 | 119.7° | 119.5° |
N9 | C14 | C12 | N15 | 148.8° | 117.7° |
N9 | C14 | H1 | H2 | 121.0° | 121.3° |
C14 | N9 | C10 | H7 | 135.5° | 79.3° |
C14 | N9 | C10 | H8 | 103.2° | 157.6° |
N9 | C14 | C12 | H9 | 87.2° | 120.1° |
C11 | C12 | C14 | N15 | 118.6° | 118.9° |
C11 | C12 | C14 | H9 | 117.4° | 118.9° |
C11 | C12 | N15 | H9 | 124.8° | 122.2° |
C11 | C12 | N15 | C16 | 162.9° | 89.3° |
C11 | C12 | C14 | H1 | 149.9° | 120.6° |
C11 | C12 | C14 | H2 | 89.4° | 118.3° |
C12 | C11 | H5 | H6 | 123.6° | 123.1° |
C12 | C11 | C10 | H7 | 153.7° | 81.0° |
C12 | C11 | C10 | H8 | 84.9° | 155.9° |
C11 | C12 | N15 | H14 | 17.1° | 90.7° |
C14 | C12 | N15 | H9 | 123.4° | 122.1° |
C14 | C12 | N15 | C16 | 85.3° | 155.0° |
C12 | C14 | H1 | H2 | 121.0° | 121.1° |
C14 | C12 | C11 | H5 | 80.1° | 96.4° |
C14 | C12 | C11 | H6 | 157.4° | 140.5° |
C14 | C12 | N15 | H14 | 94.6° | 24.9° |
C12 | N15 | C16 | H14 | 180.0° | 179.9° |
C12 | N15 | C16 | O17 | 23.5° | 0.0° |
C12 | N15 | C16 | N18 | 156.9° | 179.9° |
N15 | C12 | C14 | H1 | 91.5° | 1.7° |
N15 | C12 | C14 | H2 | 29.2° | 122.8° |
N15 | C12 | C11 | H5 | 36.8° | 22.5° |
N15 | C12 | C11 | H6 | 85.8° | 100.6° |
N15 | C16 | O17 | N18 | 179.6° | 179.9° |
N15 | C16 | N18 | C19 | 177.5° | 175.2° |
C16 | N15 | C12 | H9 | 38.1° | 32.9° |
N15 | C16 | N18 | H15 | 2.5° | 4.7° |
O17 | C16 | N18 | C19 | 2.9° | 4.8° |
O17 | C16 | N15 | H14 | 156.5° | 179.9° |
O17 | C16 | N18 | H15 | 177.1° | 175.2° |
C16 | N18 | C19 | H15 | 180.0° | 180.0° |
C16 | N18 | C19 | C31 | 33.4° | 144.7° |
C16 | N18 | C19 | C20 | 144.8° | 35.6° |
N18 | C16 | N15 | H14 | 23.2° | 0.0° |
N18 | C19 | C31 | C20 | 178.2° | 179.7° |
N18 | C19 | C31 | C30 | 178.6° | 179.8° |
N18 | C19 | C20 | C21 | 178.4° | 180.0° |
N18 | C19 | C20 | H16 | 1.6° | 0.1° |
N18 | C19 | C31 | H29 | 1.4° | 0.0° |
C19 | C31 | C30 | H29 | 180.0° | 179.8° |
C31 | C19 | C20 | C21 | 0.1° | 0.3° |
C19 | C31 | C30 | C32 | 179.8° | 179.7° |
C19 | C31 | C30 | C22 | 0.2° | 0.5° |
C31 | C19 | N18 | H15 | 146.6° | 35.2° |
C31 | C19 | C20 | H16 | 179.9° | 179.8° |
C20 | C19 | C31 | C30 | 0.4° | 0.5° |
C19 | C20 | C21 | H16 | 180.0° | 179.9° |
C19 | C20 | C21 | C22 | 0.6° | 0.0° |
C20 | C19 | N18 | H15 | 35.1° | 144.5° |
C19 | C20 | C21 | H17 | 179.5° | 180.0° |
C20 | C19 | C31 | H29 | 179.6° | 179.7° |
C31 | C30 | C32 | F33 | 3.0° | 125.1° |
C31 | C30 | C32 | C22 | 179.6° | 179.8° |
C31 | C30 | C32 | F34 | 121.9° | 114.9° |
C31 | C30 | C32 | F35 | 117.9° | 5.1° |
C31 | C30 | C22 | C21 | 0.4° | 0.2° |
C31 | C30 | C22 | C23 | 179.6° | 179.8° |
C20 | C21 | C22 | C30 | 0.8° | 0.0° |
C20 | C21 | C22 | H17 | 180.0° | 180.0° |
C20 | C21 | C22 | C23 | 180.0° | 180.0° |
F33 | C32 | C30 | F34 | 118.9° | 120.0° |
F33 | C32 | C30 | F35 | 120.9° | 120.0° |
F33 | C32 | C30 | C22 | 176.6° | 55.1° |
F33 | C32 | F34 | F35 | 116.5° | 120.0° |
C30 | C32 | F34 | F35 | 121.8° | 120.0° |
C32 | C30 | C22 | C21 | 179.2° | 180.0° |
C32 | C30 | C22 | C23 | 0.1° | 0.0° |
C32 | C30 | C31 | H29 | 0.2° | 0.0° |
C22 | C30 | C32 | F34 | 57.7° | 64.8° |
C22 | C30 | C32 | F35 | 62.5° | 175.1° |
C30 | C22 | C21 | C23 | 179.2° | 180.0° |
C30 | C22 | C23 | N24 | 163.4° | 75.0° |
C30 | C22 | C21 | H17 | 179.2° | 180.0° |
C30 | C22 | C23 | H18 | 75.9° | 45.0° |
C30 | C22 | C23 | H19 | 42.7° | 165.0° |
C22 | C30 | C31 | H29 | 179.8° | 179.8° |
C21 | C22 | C23 | N24 | 17.4° | 105.0° |
C22 | C21 | C20 | H16 | 179.4° | 179.9° |
C21 | C22 | C23 | H18 | 103.3° | 135.0° |
C21 | C22 | C23 | H19 | 138.1° | 15.0° |
C22 | C23 | N24 | H18 | 120.7° | 119.9° |
C22 | C23 | N24 | H19 | 120.7° | 120.0° |
C22 | C23 | N24 | C25 | 153.6° | 164.5° |
C22 | C23 | N24 | C29 | 80.5° | 71.9° |
C23 | C22 | C21 | H17 | 0.0° | 0.0° |
C22 | C23 | H18 | H19 | 117.9° | 120.0° |
C23 | N24 | C25 | C29 | 124.7° | 123.8° |
C23 | N24 | C25 | C26 | 177.3° | 177.6° |
C23 | N24 | C29 | C28 | 178.1° | 177.6° |
N24 | C23 | H18 | H19 | 117.8° | 120.0° |
C23 | N24 | C25 | H21 | 62.6° | 57.7° |
C23 | N24 | C25 | H22 | 57.1° | 62.4° |
C23 | N24 | C29 | H27 | 62.1° | 62.4° |
C23 | N24 | C29 | H28 | 58.3° | 57.7° |
N24 | C25 | C26 | H21 | 120.2° | 119.9° |
N24 | C25 | C26 | H22 | 120.2° | 119.9° |
C25 | N24 | C29 | C28 | 56.8° | 58.6° |
N24 | C25 | C26 | O27 | 51.6° | 56.9° |
C25 | N24 | C23 | H18 | 32.9° | 44.6° |
C25 | N24 | C23 | H19 | 85.7° | 75.5° |
N24 | C25 | H21 | H22 | 119.5° | 120.1° |
N24 | C25 | C26 | H23 | 68.4° | 63.1° |
N24 | C25 | C26 | H24 | 171.6° | 176.8° |
C25 | N24 | C29 | H27 | 63.0° | 61.4° |
C25 | N24 | C29 | H28 | 176.6° | 178.6° |
C29 | N24 | C25 | C26 | 52.5° | 58.6° |
N24 | C29 | C28 | H27 | 119.8° | 120.0° |
N24 | C29 | C28 | H28 | 119.8° | 120.0° |
N24 | C29 | C28 | O27 | 60.6° | 56.9° |
C29 | N24 | C23 | H18 | 158.8° | 168.2° |
C29 | N24 | C23 | H19 | 40.2° | 48.1° |
C29 | N24 | C25 | H21 | 172.7° | 178.5° |
C29 | N24 | C25 | H22 | 67.6° | 61.3° |
N24 | C29 | C28 | H25 | 179.7° | 63.1° |
N24 | C29 | C28 | H26 | 59.1° | 176.8° |
N24 | C29 | H27 | H28 | 120.5° | 120.1° |
C25 | C26 | O27 | H23 | 120.0° | 120.0° |
C25 | C26 | O27 | H24 | 120.0° | 119.9° |
C25 | C26 | O27 | C28 | 59.9° | 58.7° |
C26 | C25 | H21 | H22 | 119.5° | 120.1° |
C25 | C26 | H23 | H24 | 120.0° | 120.1° |
C29 | C28 | O27 | C26 | 64.7° | 58.7° |
C29 | C28 | O27 | H25 | 119.7° | 120.0° |
C29 | C28 | O27 | H26 | 119.7° | 120.0° |
C29 | C28 | H25 | H26 | 120.9° | 120.2° |
C28 | C29 | H27 | H28 | 120.5° | 120.1° |
O27 | C26 | C25 | H21 | 171.8° | 176.8° |
O27 | C26 | C25 | H22 | 68.5° | 63.1° |
O27 | C26 | H23 | H24 | 120.0° | 120.1° |
C26 | O27 | C28 | H25 | 175.6° | 61.3° |
C26 | O27 | C28 | H26 | 55.1° | 178.7° |
C28 | O27 | C26 | H23 | 60.1° | 61.3° |
C28 | O27 | C26 | H24 | 179.9° | 178.6° |
O27 | C28 | H25 | H26 | 120.8° | 120.0° |
O27 | C28 | C29 | H27 | 59.2° | 63.1° |
O27 | C28 | C29 | H28 | 179.5° | 176.8° |
H1 | C14 | C12 | H9 | 32.4° | 120.5° |
H2 | C14 | C12 | H9 | 153.1° | 0.6° |
H3 | C5 | C6 | H4 | 0.1° | 0.0° |
H5 | C11 | C10 | H7 | 34.9° | 160.6° |
H5 | C11 | C10 | H8 | 156.3° | 37.5° |
H5 | C11 | C12 | H9 | 162.3° | 144.7° |
H6 | C11 | C10 | H7 | 87.6° | 37.4° |
H6 | C11 | C10 | H8 | 33.8° | 85.7° |
H6 | C11 | C12 | H9 | 39.7° | 21.6° |
H9 | C12 | N15 | H14 | 142.0° | 147.1° |
H10 | N2 | C1 | H11 | 58.3° | 0.0° |
H10 | N2 | C1 | H12 | 61.7° | 119.9° |
H10 | N2 | C1 | H13 | 178.4° | 120.0° |
H11 | C1 | H12 | H13 | 120.0° | 120.0° |
H16 | C20 | C21 | H17 | 0.5° | 0.1° |
H21 | C25 | C26 | H23 | 51.8° | 56.8° |
H21 | C25 | C26 | H24 | 68.2° | 63.3° |
H22 | C25 | C26 | H23 | 171.5° | 177.0° |
H22 | C25 | C26 | H24 | 51.4° | 56.8° |
H25 | C28 | C29 | H27 | 60.5° | 176.9° |
H25 | C28 | C29 | H28 | 59.8° | 56.9° |
H26 | C28 | C29 | H27 | 178.9° | 56.9° |
H26 | C28 | C29 | H28 | 60.7° | 63.2° |