ZO4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
C12 | C11 | sing | 1.53Å | 1.53Å | |
C13 | C11 | sing | 1.53Å | 1.52Å | |
C1 | C11 | sing | 1.51Å | 1.50Å | |
C1 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
C11 | N3 | sing | 1.47Å | 1.47Å | |
C5 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
C5 | C7 | sing | 1.48Å | 1.50Å | |
C9 | C7 | doub | 1.33Å | 1.32Å | |
C7 | C8 | sing | 1.51Å | 1.32Å | |
N3 | C10 | sing | 1.35Å | 1.34Å | |
O5 | C26 | sing | 1.43Å | 1.43Å | |
O2 | C10 | doub | 1.22Å | 1.22Å | |
C10 | N4 | sing | 1.35Å | 1.34Å | |
C26 | C27 | sing | 1.53Å | 1.53Å | |
C26 | C25 | sing | 1.53Å | 1.53Å | |
N4 | C17 | sing | 1.40Å | 1.37Å | |
O6 | C27 | sing | 1.43Å | 1.43Å | |
C27 | C29 | sing | 1.53Å | 1.53Å | |
O4 | C25 | sing | 1.43Å | 1.43Å | |
C25 | C24 | sing | 1.53Å | 1.53Å | |
C17 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
C17 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
C22 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
C29 | O3 | sing | 1.43Å | 1.43Å | |
C24 | O3 | sing | 1.43Å | 1.43Å | |
C24 | N1 | sing | 1.47Å | 1.47Å | |
C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
C21 | N1 | sing | 1.40Å | 1.37Å | |
C21 | C20 | doub | 1.39Å | 1.38Å | Aromatic |
C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
C20 | CL | sing | 1.74Å | 1.80Å | |
C12 | H1 | sing | 1.09Å | 1.10Å | |
C12 | H2 | sing | 1.09Å | 1.10Å | |
C12 | H3 | sing | 1.09Å | 1.10Å | |
C13 | H4 | sing | 1.09Å | 1.10Å | |
C13 | H5 | sing | 1.09Å | 1.10Å | |
C13 | H6 | sing | 1.09Å | 1.10Å | |
C18 | H7 | sing | 1.08Å | 1.08Å | |
C19 | H8 | sing | 1.08Å | 1.08Å | |
C2 | H9 | sing | 1.08Å | 1.08Å | |
C22 | H10 | sing | 1.08Å | 1.08Å | |
C24 | H11 | sing | 1.09Å | 1.10Å | |
C25 | H12 | sing | 1.09Å | 1.10Å | |
C26 | H13 | sing | 1.09Å | 1.10Å | |
C27 | H14 | sing | 1.09Å | 1.10Å | |
C29 | H15 | sing | 1.09Å | 1.10Å | |
C29 | H16 | sing | 1.09Å | 1.10Å | |
C3 | H17 | sing | 1.08Å | 1.08Å | |
C4 | H18 | sing | 1.08Å | 1.08Å | |
C6 | H19 | sing | 1.08Å | 1.08Å | |
C8 | H20 | sing | 1.09Å | 1.10Å | |
C8 | H21 | sing | 1.09Å | 1.10Å | |
C8 | H22 | sing | 1.09Å | 1.10Å | |
C9 | H23 | sing | 1.08Å | 1.08Å | |
C9 | H24 | sing | 1.08Å | 1.08Å | |
N1 | H25 | sing | 0.97Å | 1.00Å | |
N3 | H26 | sing | 0.97Å | 1.00Å | |
N4 | H27 | sing | 0.97Å | 1.00Å | |
O4 | H28 | sing | 0.97Å | 0.95Å | |
O5 | H29 | sing | 0.97Å | 0.95Å | |
O6 | H30 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C3 | C4 | 120.1° | 120.2° |
C3 | C2 | C1 | 119.9° | 120.3° |
C3 | C2 | H9 | 120.0° | 119.9° |
C2 | C3 | H17 | 119.9° | 119.9° |
C3 | C4 | C5 | 119.8° | 119.8° |
C4 | C3 | H17 | 119.9° | 119.9° |
C3 | C4 | H18 | 120.1° | 120.1° |
C2 | C1 | C11 | 120.4° | 119.9° |
C2 | C1 | C6 | 119.9° | 120.2° |
C1 | C2 | H9 | 120.0° | 119.8° |
C4 | C5 | C6 | 120.0° | 119.7° |
C4 | C5 | C7 | 120.3° | 120.1° |
C5 | C4 | H18 | 120.1° | 120.1° |
C12 | C11 | C13 | 108.0° | 109.5° |
C12 | C11 | C1 | 109.5° | 109.4° |
C12 | C11 | N3 | 113.4° | 109.5° |
C11 | C12 | H1 | 109.5° | 109.5° |
C11 | C12 | H2 | 109.5° | 109.5° |
C11 | C12 | H3 | 109.5° | 109.5° |
C13 | C11 | C1 | 106.8° | 109.5° |
C13 | C11 | N3 | 109.0° | 109.5° |
C11 | C13 | H4 | 109.5° | 109.5° |
C11 | C13 | H5 | 109.5° | 109.5° |
C11 | C13 | H6 | 109.5° | 109.5° |
C11 | C1 | C6 | 119.7° | 119.9° |
C1 | C11 | N3 | 109.8° | 109.5° |
C1 | C6 | C5 | 120.2° | 119.8° |
C1 | C6 | H19 | 119.9° | 120.1° |
C11 | N3 | C10 | 129.0° | 120.0° |
C11 | N3 | H26 | 115.5° | 120.0° |
C6 | C5 | C7 | 119.7° | 120.1° |
C5 | C6 | H19 | 119.9° | 120.1° |
C5 | C7 | C9 | 120.1° | 120.0° |
C5 | C7 | C8 | 119.9° | 120.0° |
C9 | C7 | C8 | 119.9° | 120.0° |
C7 | C9 | H23 | 120.0° | 120.0° |
C7 | C9 | H24 | 120.0° | 120.0° |
C7 | C8 | H20 | 109.5° | 109.4° |
C7 | C8 | H21 | 109.4° | 109.4° |
C7 | C8 | H22 | 109.5° | 109.5° |
N3 | C10 | O2 | 122.7° | 120.0° |
N3 | C10 | N4 | 113.7° | 120.0° |
C10 | N3 | H26 | 115.5° | 120.0° |
O5 | C26 | C27 | 109.7° | 109.6° |
O5 | C26 | C25 | 109.5° | 109.5° |
O5 | C26 | H13 | 109.7° | 109.6° |
C26 | O5 | H29 | 109.5° | 114.0° |
O2 | C10 | N4 | 123.5° | 120.0° |
C10 | N4 | C17 | 130.3° | 120.0° |
C10 | N4 | H27 | 114.8° | 120.0° |
C27 | C26 | C25 | 111.1° | 109.1° |
C26 | C27 | O6 | 109.8° | 109.5° |
C26 | C27 | C29 | 110.8° | 109.2° |
C27 | C26 | H13 | 108.4° | 109.5° |
C26 | C27 | H14 | 108.4° | 109.6° |
C26 | C25 | O4 | 110.1° | 109.6° |
C26 | C25 | C24 | 110.1° | 109.1° |
C26 | C25 | H12 | 108.6° | 109.5° |
C25 | C26 | H13 | 108.4° | 109.5° |
N4 | C17 | C22 | 125.1° | 120.1° |
N4 | C17 | C18 | 115.9° | 120.0° |
C17 | N4 | H27 | 114.9° | 120.0° |
O6 | C27 | C29 | 109.7° | 109.5° |
O6 | C27 | H14 | 109.7° | 109.6° |
C27 | O6 | H30 | 109.5° | 114.0° |
C27 | C29 | O3 | 109.7° | 109.4° |
C29 | C27 | H14 | 108.4° | 109.5° |
C27 | C29 | H15 | 109.4° | 109.5° |
C27 | C29 | H16 | 109.4° | 109.5° |
O4 | C25 | C24 | 109.7° | 109.5° |
O4 | C25 | H12 | 109.8° | 109.5° |
C25 | O4 | H28 | 109.5° | 114.0° |
C25 | C24 | O3 | 109.6° | 109.5° |
C25 | C24 | N1 | 114.0° | 109.5° |
C25 | C24 | H11 | 107.3° | 109.5° |
C24 | C25 | H12 | 108.5° | 109.5° |
C22 | C17 | C18 | 119.0° | 120.0° |
C17 | C22 | C21 | 120.7° | 119.9° |
C17 | C22 | H10 | 119.7° | 120.0° |
C17 | C18 | C19 | 120.8° | 120.0° |
C17 | C18 | H7 | 119.6° | 120.0° |
C22 | C21 | N1 | 128.3° | 120.0° |
C22 | C21 | C20 | 118.8° | 119.9° |
C21 | C22 | H10 | 119.7° | 120.1° |
C29 | O3 | C24 | 111.8° | 114.1° |
O3 | C29 | H15 | 109.4° | 109.5° |
O3 | C29 | H16 | 109.4° | 109.5° |
O3 | C24 | N1 | 109.3° | 109.5° |
O3 | C24 | H11 | 108.5° | 109.5° |
C24 | N1 | C21 | 136.5° | 120.0° |
N1 | C24 | H11 | 108.0° | 109.5° |
C24 | N1 | H25 | 102.3° | 120.0° |
C18 | C19 | C20 | 119.5° | 120.2° |
C19 | C18 | H7 | 119.6° | 120.0° |
C18 | C19 | H8 | 120.3° | 119.9° |
N1 | C21 | C20 | 113.0° | 120.0° |
C21 | N1 | H25 | 102.4° | 120.0° |
C21 | C20 | C19 | 121.3° | 120.1° |
C21 | C20 | CL | 118.2° | 120.0° |
C19 | C20 | CL | 120.5° | 120.0° |
C20 | C19 | H8 | 120.2° | 119.9° |
H1 | C12 | H2 | 109.4° | 109.5° |
H1 | C12 | H3 | 109.5° | 109.5° |
H2 | C12 | H3 | 109.5° | 109.4° |
H4 | C13 | H5 | 109.5° | 109.5° |
H4 | C13 | H6 | 109.5° | 109.4° |
H5 | C13 | H6 | 109.5° | 109.4° |
H15 | C29 | H16 | 109.5° | 109.5° |
H20 | C8 | H21 | 109.5° | 109.5° |
H20 | C8 | H22 | 109.5° | 109.5° |
H21 | C8 | H22 | 109.5° | 109.5° |
H23 | C9 | H24 | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C3 | C4 | H17 | 180.0° | 180.0° |
C3 | C2 | C1 | H9 | 180.0° | 180.0° |
C2 | C3 | C4 | C5 | 0.0° | 0.0° |
C3 | C2 | C1 | C11 | 179.5° | 180.0° |
C3 | C2 | C1 | C6 | 0.9° | 0.3° |
C2 | C3 | C4 | H18 | 180.0° | 179.9° |
C4 | C3 | C2 | C1 | 0.4° | 0.0° |
C3 | C4 | C5 | H18 | 180.0° | 179.9° |
C3 | C4 | C5 | C6 | 0.0° | 0.3° |
C3 | C4 | C5 | C7 | 180.0° | 180.0° |
C4 | C3 | C2 | H9 | 179.6° | 180.0° |
C2 | C1 | C11 | C12 | 24.8° | 145.0° |
C2 | C1 | C11 | C13 | 92.0° | 95.0° |
C2 | C1 | C11 | C6 | 178.6° | 179.7° |
C2 | C1 | C11 | N3 | 149.9° | 25.0° |
C2 | C1 | C6 | C5 | 0.9° | 0.5° |
C1 | C2 | C3 | H17 | 179.6° | 180.0° |
C2 | C1 | C6 | H19 | 179.1° | 179.7° |
C4 | C5 | C6 | C1 | 0.4° | 0.5° |
C4 | C5 | C6 | C7 | 180.0° | 179.7° |
C4 | C5 | C7 | C9 | 4.1° | 115.0° |
C4 | C5 | C7 | C8 | 175.9° | 65.1° |
C5 | C4 | C3 | H17 | 179.9° | 180.0° |
C4 | C5 | C6 | H19 | 179.6° | 179.7° |
C12 | C11 | C13 | C1 | 117.8° | 120.0° |
C12 | C11 | C13 | N3 | 123.6° | 120.0° |
C12 | C11 | C1 | N3 | 125.2° | 120.0° |
C12 | C11 | C1 | C6 | 156.6° | 35.2° |
C12 | C11 | N3 | C10 | 47.8° | 61.1° |
C11 | C12 | H1 | H2 | 120.0° | 120.0° |
C11 | C12 | H1 | H3 | 120.0° | 120.0° |
C11 | C12 | H2 | H3 | 120.0° | 120.0° |
C12 | C11 | C13 | H4 | 180.0° | 179.9° |
C12 | C11 | C13 | H5 | 60.0° | 60.0° |
C12 | C11 | C13 | H6 | 60.0° | 59.9° |
C12 | C11 | N3 | H26 | 132.2° | 118.8° |
C13 | C11 | C1 | N3 | 118.0° | 120.0° |
C13 | C11 | C1 | C6 | 86.6° | 84.7° |
C13 | C11 | N3 | C10 | 168.2° | 58.9° |
C13 | C11 | C12 | H1 | 180.0° | 60.0° |
C13 | C11 | C12 | H2 | 60.0° | 60.0° |
C13 | C11 | C12 | H3 | 60.0° | 180.0° |
C11 | C13 | H4 | H5 | 120.0° | 120.1° |
C11 | C13 | H4 | H6 | 120.0° | 120.0° |
C11 | C13 | H5 | H6 | 120.0° | 120.0° |
C13 | C11 | N3 | H26 | 11.8° | 121.2° |
C11 | C1 | C6 | C5 | 179.5° | 179.7° |
C1 | C11 | N3 | C10 | 75.1° | 178.9° |
C1 | C11 | C12 | H1 | 64.0° | 60.0° |
C1 | C11 | C12 | H2 | 176.1° | 180.0° |
C1 | C11 | C12 | H3 | 56.0° | 60.0° |
C1 | C11 | C13 | H4 | 62.2° | 60.0° |
C1 | C11 | C13 | H5 | 57.8° | 179.9° |
C1 | C11 | C13 | H6 | 177.8° | 60.0° |
C11 | C1 | C2 | H9 | 0.5° | 0.0° |
C11 | C1 | C6 | H19 | 0.5° | 0.0° |
C1 | C11 | N3 | H26 | 104.9° | 1.2° |
C6 | C1 | C11 | N3 | 31.5° | 155.2° |
C1 | C6 | C5 | H19 | 180.0° | 179.8° |
C1 | C6 | C5 | C7 | 179.5° | 179.7° |
C6 | C1 | C2 | H9 | 179.1° | 179.8° |
C11 | N3 | C10 | H26 | 180.0° | 179.9° |
C11 | N3 | C10 | O2 | 0.3° | 0.0° |
C11 | N3 | C10 | N4 | 180.0° | 180.0° |
N3 | C11 | C12 | H1 | 59.1° | 180.0° |
N3 | C11 | C12 | H2 | 60.9° | 60.0° |
N3 | C11 | C12 | H3 | 179.1° | 60.0° |
N3 | C11 | C13 | H4 | 56.3° | 60.0° |
N3 | C11 | C13 | H5 | 176.3° | 60.1° |
N3 | C11 | C13 | H6 | 63.7° | 180.0° |
C6 | C5 | C7 | C9 | 175.8° | 64.7° |
C6 | C5 | C7 | C8 | 4.2° | 115.2° |
C6 | C5 | C4 | H18 | 180.0° | 179.8° |
C5 | C7 | C9 | C8 | 180.0° | 179.9° |
C7 | C5 | C4 | H18 | 0.0° | 0.1° |
C7 | C5 | C6 | H19 | 0.5° | 0.0° |
C5 | C7 | C8 | H20 | 180.0° | 90.1° |
C5 | C7 | C8 | H21 | 60.0° | 150.0° |
C5 | C7 | C8 | H22 | 60.0° | 30.0° |
C5 | C7 | C9 | H23 | 180.0° | 180.0° |
C5 | C7 | C9 | H24 | 0.0° | 0.1° |
C9 | C7 | C8 | H20 | 0.0° | 90.0° |
C9 | C7 | C8 | H21 | 120.0° | 29.9° |
C9 | C7 | C8 | H22 | 120.0° | 149.9° |
C7 | C9 | H23 | H24 | 180.0° | 179.9° |
C7 | C8 | H20 | H21 | 120.0° | 119.9° |
C7 | C8 | H20 | H22 | 120.0° | 120.0° |
C7 | C8 | H21 | H22 | 120.0° | 120.0° |
C8 | C7 | C9 | H23 | 0.0° | 0.1° |
C8 | C7 | C9 | H24 | 180.0° | 180.0° |
N3 | C10 | O2 | N4 | 179.7° | 179.9° |
N3 | C10 | N4 | C17 | 179.8° | 174.8° |
N3 | C10 | N4 | H27 | 0.2° | 5.3° |
O5 | C26 | C27 | C25 | 121.3° | 119.9° |
O5 | C26 | C27 | H13 | 119.7° | 120.3° |
O5 | C26 | C25 | H13 | 119.6° | 120.3° |
O5 | C26 | C27 | O6 | 54.9° | 57.0° |
O5 | C26 | C27 | C29 | 176.2° | 62.9° |
O5 | C26 | C25 | O4 | 45.2° | 57.0° |
O5 | C26 | C25 | C24 | 166.3° | 62.9° |
O5 | C26 | C25 | H12 | 75.0° | 177.2° |
O5 | C26 | C27 | H14 | 64.9° | 177.2° |
O2 | C10 | N4 | C17 | 0.1° | 5.1° |
O2 | C10 | N3 | H26 | 179.7° | 180.0° |
O2 | C10 | N4 | H27 | 179.9° | 174.8° |
C10 | N4 | C17 | H27 | 180.0° | 179.9° |
C10 | N4 | C17 | C22 | 0.1° | 146.9° |
C10 | N4 | C17 | C18 | 179.9° | 33.4° |
N4 | C10 | N3 | H26 | 0.0° | 0.1° |
C27 | C26 | C25 | H13 | 119.0° | 119.8° |
C26 | C27 | O6 | C29 | 122.0° | 119.7° |
C26 | C27 | O6 | H14 | 119.0° | 120.2° |
C26 | C27 | C29 | H14 | 118.9° | 120.0° |
C27 | C26 | C25 | O4 | 76.1° | 177.0° |
C27 | C26 | C25 | C24 | 45.0° | 57.0° |
C26 | C27 | C29 | O3 | 4.2° | 57.6° |
C27 | C26 | C25 | H12 | 163.6° | 62.9° |
C26 | C27 | C29 | H15 | 124.2° | 62.3° |
C26 | C27 | C29 | H16 | 115.9° | 177.6° |
C27 | C26 | O5 | H29 | 180.0° | 60.0° |
C26 | C27 | O6 | H30 | 180.0° | 180.0° |
C25 | C26 | C27 | O6 | 66.4° | 176.9° |
C25 | C26 | C27 | C29 | 54.9° | 57.0° |
C26 | C25 | O4 | C24 | 121.3° | 119.7° |
C26 | C25 | O4 | H12 | 119.5° | 120.2° |
C26 | C25 | C24 | H12 | 118.7° | 119.9° |
C26 | C25 | C24 | O3 | 13.1° | 57.6° |
C26 | C25 | C24 | N1 | 136.0° | 177.6° |
C26 | C25 | C24 | H11 | 104.5° | 62.4° |
C25 | C26 | C27 | H14 | 173.8° | 62.9° |
C26 | C25 | O4 | H28 | 180.0° | 179.7° |
C25 | C26 | O5 | H29 | 57.8° | 179.6° |
N4 | C17 | C22 | C18 | 179.9° | 179.7° |
N4 | C17 | C22 | C21 | 179.8° | 179.7° |
N4 | C17 | C18 | C19 | 180.0° | 179.7° |
N4 | C17 | C18 | H7 | 0.0° | 0.3° |
N4 | C17 | C22 | H10 | 0.2° | 0.2° |
O6 | C27 | C29 | H14 | 119.7° | 120.1° |
O6 | C27 | C29 | O3 | 117.2° | 177.5° |
O6 | C27 | C26 | H13 | 174.6° | 63.3° |
O6 | C27 | C29 | H15 | 2.8° | 57.6° |
O6 | C27 | C29 | H16 | 122.7° | 62.5° |
C27 | C29 | O3 | H15 | 120.0° | 120.0° |
C27 | C29 | O3 | H16 | 120.1° | 120.0° |
C27 | C29 | O3 | C24 | 58.4° | 61.1° |
C29 | C27 | C26 | H13 | 64.1° | 176.8° |
C27 | C29 | H15 | H16 | 119.9° | 120.1° |
C29 | C27 | O6 | H30 | 58.0° | 60.3° |
O4 | C25 | C24 | H12 | 120.0° | 120.1° |
O4 | C25 | C24 | O3 | 134.5° | 177.6° |
O4 | C25 | C24 | N1 | 102.7° | 62.4° |
O4 | C25 | C24 | H11 | 16.8° | 57.6° |
O4 | C25 | C26 | H13 | 164.9° | 63.2° |
C25 | C24 | O3 | C29 | 68.8° | 61.1° |
C25 | C24 | O3 | N1 | 125.6° | 120.0° |
C25 | C24 | O3 | H11 | 116.9° | 120.0° |
C25 | C24 | N1 | H11 | 119.1° | 120.0° |
C25 | C24 | N1 | C21 | 20.8° | 145.0° |
C24 | C25 | C26 | H13 | 74.0° | 176.8° |
C25 | C24 | N1 | H25 | 102.5° | 35.0° |
C24 | C25 | O4 | H28 | 58.7° | 60.0° |
C17 | C22 | C21 | H10 | 180.0° | 179.9° |
C22 | C17 | C18 | C19 | 0.1° | 0.0° |
C17 | C22 | C21 | N1 | 179.9° | 180.0° |
C17 | C22 | C21 | C20 | 0.4° | 0.0° |
C22 | C17 | C18 | H7 | 180.0° | 180.0° |
C22 | C17 | N4 | H27 | 179.9° | 33.0° |
C18 | C17 | C22 | C21 | 0.3° | 0.0° |
C17 | C18 | C19 | H7 | 180.0° | 179.9° |
C17 | C18 | C19 | C20 | 0.1° | 0.1° |
C17 | C18 | C19 | H8 | 179.9° | 180.0° |
C18 | C17 | C22 | H10 | 179.7° | 179.9° |
C18 | C17 | N4 | H27 | 0.1° | 146.7° |
C22 | C21 | N1 | C24 | 0.0° | 0.0° |
C22 | C21 | N1 | C20 | 179.8° | 180.0° |
C22 | C21 | C20 | C19 | 0.2° | 0.1° |
C22 | C21 | C20 | CL | 179.8° | 180.0° |
C22 | C21 | N1 | H25 | 123.3° | 180.0° |
C29 | O3 | C24 | N1 | 165.6° | 178.9° |
C29 | O3 | C24 | H11 | 48.0° | 58.9° |
O3 | C29 | C27 | H14 | 123.1° | 62.3° |
O3 | C29 | H15 | H16 | 119.9° | 120.0° |
O3 | C24 | N1 | H11 | 117.9° | 120.0° |
O3 | C24 | N1 | C21 | 102.2° | 95.0° |
O3 | C24 | C25 | H12 | 105.5° | 62.3° |
C24 | O3 | C29 | H15 | 61.6° | 58.8° |
C24 | O3 | C29 | H16 | 178.5° | 178.9° |
O3 | C24 | N1 | H25 | 134.5° | 85.0° |
C24 | N1 | C21 | H25 | 123.3° | 180.0° |
C24 | N1 | C21 | C20 | 179.7° | 180.0° |
N1 | C24 | C25 | H12 | 17.3° | 57.7° |
C18 | C19 | C20 | C21 | 0.0° | 0.1° |
C18 | C19 | C20 | H8 | 180.0° | 179.9° |
C18 | C19 | C20 | CL | 180.0° | 180.0° |
N1 | C21 | C20 | C19 | 180.0° | 180.0° |
N1 | C21 | C20 | CL | 0.0° | 0.1° |
N1 | C21 | C22 | H10 | 0.1° | 0.0° |
C21 | N1 | C24 | H11 | 139.9° | 25.0° |
C21 | C20 | C19 | CL | 180.0° | 179.9° |
C21 | C20 | C19 | H8 | 180.0° | 180.0° |
C20 | C21 | C22 | H10 | 179.6° | 179.9° |
C20 | C21 | N1 | H25 | 57.0° | 0.0° |
C20 | C19 | C18 | H7 | 179.9° | 180.0° |
CL | C20 | C19 | H8 | 0.0° | 0.1° |
H1 | C12 | H2 | H3 | 120.0° | 120.0° |
H4 | C13 | H5 | H6 | 120.0° | 119.9° |
H7 | C18 | C19 | H8 | 0.1° | 0.1° |
H9 | C2 | C3 | H17 | 0.4° | 0.0° |
H11 | C24 | C25 | H12 | 136.8° | 177.7° |
H11 | C24 | N1 | H25 | 16.6° | 155.0° |
H12 | C25 | C26 | H13 | 44.6° | 57.0° |
H12 | C25 | O4 | H28 | 60.5° | 60.1° |
H13 | C26 | C27 | H14 | 54.8° | 56.9° |
H13 | C26 | O5 | H29 | 61.0° | 60.2° |
H14 | C27 | C29 | H15 | 116.9° | 177.7° |
H14 | C27 | C29 | H16 | 3.0° | 57.7° |
H14 | C27 | O6 | H30 | 60.9° | 59.8° |
H17 | C3 | C4 | H18 | 0.0° | 0.1° |
H20 | C8 | H21 | H22 | 120.0° | 120.1° |