2I7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3 | C3 | sing | 1.43Å | 1.44Å | |
O2 | C2 | sing | 1.43Å | 1.48Å | |
C3 | C2 | sing | 1.53Å | 1.46Å | |
C3 | C4 | sing | 1.53Å | 1.58Å | |
O4 | C6 | sing | 1.43Å | 1.38Å | |
C2 | C1 | sing | 1.53Å | 1.47Å | |
C4 | N1 | sing | 1.47Å | 1.49Å | |
C1 | O1 | sing | 1.43Å | 1.45Å | |
C1 | C5 | sing | 1.53Å | 1.58Å | |
N1 | C7 | sing | 1.47Å | 1.31Å | |
N1 | C5 | sing | 1.47Å | 1.48Å | |
C7 | C8 | sing | 1.51Å | 1.62Å | |
C5 | C6 | sing | 1.53Å | 1.56Å | |
C19 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
C19 | N3 | sing | 1.32Å | 1.35Å | Aromatic |
C20 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
C8 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
C9 | C10 | sing | 1.38Å | 1.43Å | Aromatic |
N3 | C18 | doub | 1.33Å | 1.32Å | Aromatic |
C21 | N4 | doub | 1.32Å | 1.35Å | Aromatic |
C25 | C24 | doub | 1.38Å | 1.45Å | Aromatic |
C10 | C11 | sing | 1.51Å | 1.57Å | |
C10 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
C11 | N2 | sing | 1.46Å | 1.47Å | |
C18 | N4 | sing | 1.33Å | 1.34Å | Aromatic |
C18 | C17 | sing | 1.48Å | 1.55Å | |
C22 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
C22 | C12 | sing | 1.39Å | 1.42Å | Aromatic |
C24 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
C17 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
N2 | C12 | sing | 1.40Å | 1.49Å | |
C12 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
C16 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
C13 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
C14 | C15 | sing | 1.51Å | 1.56Å | |
C4 | H2 | sing | 1.09Å | 1.10Å | |
C4 | H3 | sing | 1.09Å | 1.10Å | |
C5 | H4 | sing | 1.09Å | 1.10Å | |
C6 | H5 | sing | 1.09Å | 1.10Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
C7 | H8 | sing | 1.09Å | 1.10Å | |
C13 | H9 | sing | 1.08Å | 1.08Å | |
C15 | H10 | sing | 1.09Å | 1.10Å | |
C15 | H11 | sing | 1.09Å | 1.10Å | |
C15 | H12 | sing | 1.09Å | 1.10Å | |
C20 | H13 | sing | 1.08Å | 1.08Å | |
C21 | H14 | sing | 1.08Å | 1.08Å | |
C22 | H15 | sing | 1.08Å | 1.08Å | |
C24 | H16 | sing | 1.08Å | 1.08Å | |
C1 | H17 | sing | 1.09Å | 1.10Å | |
C11 | H18 | sing | 1.09Å | 1.10Å | |
C11 | H19 | sing | 1.09Å | 1.10Å | |
C16 | H20 | sing | 1.08Å | 1.08Å | |
C19 | H21 | sing | 1.08Å | 1.08Å | |
C2 | H22 | sing | 1.09Å | 1.10Å | |
C23 | H23 | sing | 1.08Å | 1.08Å | |
C25 | H24 | sing | 1.08Å | 1.08Å | |
C3 | H25 | sing | 1.09Å | 1.10Å | |
C9 | H26 | sing | 1.08Å | 1.08Å | |
N2 | H27 | sing | 0.97Å | 1.00Å | |
O1 | H28 | sing | 0.97Å | 0.95Å | |
O2 | H29 | sing | 0.97Å | 0.95Å | |
O3 | H30 | sing | 0.97Å | 0.95Å | |
O4 | H31 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3 | C3 | C2 | 109.8° | 109.5° |
O3 | C3 | C4 | 113.6° | 109.5° |
O3 | C3 | H25 | 109.0° | 109.6° |
C3 | O3 | H30 | 109.5° | 114.0° |
O2 | C2 | C3 | 103.6° | 109.6° |
O2 | C2 | C1 | 110.5° | 109.5° |
O2 | C2 | H22 | 110.9° | 109.5° |
C2 | O2 | H29 | 109.5° | 114.0° |
C2 | C3 | C4 | 108.6° | 109.2° |
C3 | C2 | C1 | 109.5° | 109.2° |
C3 | C2 | H22 | 111.1° | 109.5° |
C2 | C3 | H25 | 108.6° | 109.5° |
C3 | C4 | N1 | 110.4° | 109.6° |
C3 | C4 | H2 | 109.3° | 109.5° |
C3 | C4 | H3 | 109.2° | 109.5° |
C4 | C3 | H25 | 107.2° | 109.5° |
O4 | C6 | C5 | 107.4° | 109.4° |
O4 | C6 | H5 | 110.0° | 109.4° |
O4 | C6 | H6 | 110.0° | 109.5° |
C6 | O4 | H31 | 109.5° | 114.0° |
C2 | C1 | O1 | 110.1° | 109.5° |
C2 | C1 | C5 | 113.1° | 109.3° |
C2 | C1 | H17 | 106.7° | 109.5° |
C1 | C2 | H22 | 111.0° | 109.6° |
C4 | N1 | C7 | 111.0° | 111.0° |
C4 | N1 | C5 | 107.3° | 111.2° |
N1 | C4 | H2 | 109.2° | 109.5° |
N1 | C4 | H3 | 109.3° | 109.5° |
O1 | C1 | C5 | 113.9° | 109.5° |
O1 | C1 | H17 | 107.0° | 109.5° |
C1 | O1 | H28 | 109.5° | 114.0° |
C1 | C5 | N1 | 108.9° | 109.5° |
C1 | C5 | C6 | 107.1° | 109.5° |
C1 | C5 | H4 | 110.1° | 109.4° |
C5 | C1 | H17 | 105.5° | 109.5° |
C7 | N1 | C5 | 120.4° | 111.0° |
N1 | C7 | C8 | 112.0° | 109.4° |
N1 | C7 | H7 | 108.8° | 109.5° |
N1 | C7 | H8 | 108.8° | 109.4° |
N1 | C5 | C6 | 108.8° | 109.4° |
N1 | C5 | H4 | 111.4° | 109.5° |
C7 | C8 | C9 | 122.3° | 120.0° |
C7 | C8 | C25 | 120.4° | 120.0° |
C8 | C7 | H7 | 108.8° | 109.5° |
C8 | C7 | H8 | 108.8° | 109.5° |
C6 | C5 | H4 | 110.4° | 109.5° |
C5 | C6 | H5 | 110.0° | 109.5° |
C5 | C6 | H6 | 110.0° | 109.4° |
C20 | C19 | N3 | 118.0° | 119.2° |
C19 | C20 | C21 | 117.7° | 118.6° |
C19 | C20 | H13 | 121.1° | 120.7° |
C20 | C19 | H21 | 121.0° | 120.5° |
C19 | N3 | C18 | 122.8° | 120.8° |
N3 | C19 | H21 | 121.0° | 120.4° |
C20 | C21 | N4 | 120.9° | 119.2° |
C21 | C20 | H13 | 121.2° | 120.7° |
C20 | C21 | H14 | 119.5° | 120.4° |
C9 | C8 | C25 | 117.1° | 120.0° |
C8 | C9 | C10 | 122.4° | 120.0° |
C8 | C9 | H26 | 118.8° | 120.0° |
C8 | C25 | C24 | 120.6° | 120.0° |
C8 | C25 | H24 | 119.7° | 120.0° |
C9 | C10 | C11 | 118.4° | 120.0° |
C9 | C10 | C23 | 119.8° | 120.0° |
C10 | C9 | H26 | 118.8° | 120.0° |
N3 | C18 | N4 | 121.0° | 121.6° |
N3 | C18 | C17 | 118.9° | 119.2° |
C21 | N4 | C18 | 119.5° | 120.7° |
N4 | C21 | H14 | 119.5° | 120.4° |
C25 | C24 | C23 | 120.8° | 120.0° |
C25 | C24 | H16 | 119.6° | 120.0° |
C24 | C25 | H24 | 119.7° | 120.0° |
C11 | C10 | C23 | 121.8° | 120.0° |
C10 | C11 | N2 | 112.0° | 109.5° |
C10 | C11 | H18 | 108.8° | 109.5° |
C10 | C11 | H19 | 108.8° | 109.5° |
C10 | C23 | C24 | 119.2° | 120.0° |
C10 | C23 | H23 | 120.4° | 120.0° |
C11 | N2 | C12 | 119.8° | 120.0° |
N2 | C11 | H18 | 108.8° | 109.5° |
N2 | C11 | H19 | 108.8° | 109.5° |
C11 | N2 | H27 | 106.9° | 120.0° |
N4 | C18 | C17 | 120.1° | 119.2° |
C18 | C17 | C22 | 120.0° | 120.1° |
C18 | C17 | C16 | 119.2° | 120.1° |
C17 | C22 | C12 | 119.0° | 119.8° |
C22 | C17 | C16 | 120.8° | 119.8° |
C17 | C22 | H15 | 120.5° | 120.1° |
C22 | C12 | N2 | 119.1° | 120.0° |
C22 | C12 | C13 | 119.8° | 120.0° |
C12 | C22 | H15 | 120.5° | 120.1° |
C23 | C24 | H16 | 119.6° | 120.0° |
C24 | C23 | H23 | 120.4° | 120.0° |
C17 | C16 | C14 | 120.4° | 120.1° |
C17 | C16 | H20 | 119.8° | 120.0° |
N2 | C12 | C13 | 121.1° | 120.0° |
C12 | N2 | H27 | 106.8° | 120.0° |
C12 | C13 | C14 | 120.5° | 120.2° |
C12 | C13 | H9 | 119.7° | 119.9° |
C16 | C14 | C13 | 119.4° | 120.2° |
C16 | C14 | C15 | 119.2° | 119.9° |
C14 | C16 | H20 | 119.8° | 120.0° |
C13 | C14 | C15 | 121.4° | 119.9° |
C14 | C13 | H9 | 119.7° | 119.9° |
C14 | C15 | H10 | 109.5° | 109.5° |
C14 | C15 | H11 | 109.5° | 109.5° |
C14 | C15 | H12 | 109.5° | 109.5° |
H2 | C4 | H3 | 109.5° | 109.4° |
H5 | C6 | H6 | 109.5° | 109.5° |
H7 | C7 | H8 | 109.5° | 109.5° |
H10 | C15 | H11 | 109.5° | 109.5° |
H10 | C15 | H12 | 109.5° | 109.4° |
H11 | C15 | H12 | 109.5° | 109.5° |
H18 | C11 | H19 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3 | C3 | C2 | O2 | 59.6° | 62.5° |
O3 | C3 | C2 | C4 | 124.7° | 119.9° |
O3 | C3 | C2 | H25 | 119.1° | 120.2° |
O3 | C3 | C4 | H25 | 120.4° | 120.2° |
O3 | C3 | C2 | C1 | 177.4° | 177.6° |
O3 | C3 | C4 | N1 | 174.4° | 179.1° |
O3 | C3 | C4 | H2 | 54.3° | 59.0° |
O3 | C3 | C4 | H3 | 65.4° | 60.9° |
O3 | C3 | C2 | H22 | 59.6° | 57.6° |
O2 | C2 | C3 | C1 | 117.9° | 119.9° |
O2 | C2 | C3 | H22 | 119.1° | 120.1° |
O2 | C2 | C3 | C4 | 175.7° | 177.6° |
O2 | C2 | C1 | H22 | 123.4° | 120.1° |
O2 | C2 | C1 | O1 | 60.8° | 62.4° |
O2 | C2 | C1 | C5 | 170.5° | 177.6° |
O2 | C2 | C1 | H17 | 54.9° | 57.7° |
O2 | C2 | C3 | H25 | 59.5° | 57.7° |
C2 | C3 | C4 | H25 | 117.1° | 119.9° |
C3 | C2 | C1 | H22 | 123.1° | 120.0° |
C2 | C3 | C4 | N1 | 63.1° | 59.2° |
C3 | C2 | C1 | O1 | 174.3° | 177.6° |
C3 | C2 | C1 | C5 | 57.0° | 57.7° |
C2 | C3 | C4 | H2 | 176.7° | 60.9° |
C2 | C3 | C4 | H3 | 57.0° | 179.2° |
C3 | C2 | C1 | H17 | 58.6° | 62.3° |
C3 | C2 | O2 | H29 | 180.0° | 60.3° |
C2 | C3 | O3 | H30 | 180.0° | 180.0° |
C4 | C3 | C2 | C1 | 57.9° | 57.6° |
C3 | C4 | N1 | H2 | 120.1° | 120.1° |
C3 | C4 | N1 | H3 | 120.1° | 120.0° |
C3 | C4 | N1 | C7 | 163.4° | 174.2° |
C3 | C4 | N1 | C5 | 63.2° | 61.8° |
C3 | C4 | H2 | H3 | 119.6° | 119.9° |
C4 | C3 | C2 | H22 | 65.1° | 62.3° |
C4 | C3 | O3 | H30 | 58.2° | 60.2° |
O4 | C6 | C5 | C1 | 73.9° | 56.6° |
O4 | C6 | C5 | N1 | 43.6° | 63.4° |
O4 | C6 | C5 | H5 | 119.7° | 120.0° |
O4 | C6 | C5 | H6 | 119.7° | 120.0° |
O4 | C6 | C5 | H4 | 166.2° | 176.6° |
O4 | C6 | H5 | H6 | 120.9° | 120.0° |
C2 | C1 | O1 | C5 | 128.2° | 119.8° |
C2 | C1 | O1 | H17 | 115.6° | 120.1° |
C2 | C1 | C5 | H17 | 116.3° | 120.0° |
C2 | C1 | C5 | N1 | 57.4° | 59.2° |
C2 | C1 | C5 | C6 | 174.9° | 179.2° |
C2 | C1 | C5 | H4 | 65.0° | 60.8° |
C1 | C2 | C3 | H25 | 58.3° | 62.2° |
C2 | C1 | O1 | H28 | 180.0° | 60.2° |
C1 | C2 | O2 | H29 | 62.8° | 180.0° |
C4 | N1 | C5 | C1 | 58.6° | 61.8° |
C4 | N1 | C7 | C5 | 126.5° | 124.1° |
C4 | N1 | C7 | C8 | 60.9° | 62.5° |
C4 | N1 | C5 | C6 | 175.0° | 178.2° |
N1 | C4 | H2 | H3 | 119.6° | 119.9° |
C4 | N1 | C5 | H4 | 63.1° | 58.2° |
C4 | N1 | C7 | H7 | 178.7° | 57.6° |
C4 | N1 | C7 | H8 | 59.4° | 177.6° |
N1 | C4 | C3 | H25 | 54.0° | 60.7° |
O1 | C1 | C5 | H17 | 117.0° | 120.1° |
O1 | C1 | C5 | N1 | 175.9° | 179.1° |
O1 | C1 | C5 | C6 | 58.4° | 60.9° |
O1 | C1 | C5 | H4 | 61.6° | 59.1° |
O1 | C1 | C2 | H22 | 62.6° | 57.6° |
C1 | C5 | N1 | C7 | 173.2° | 174.2° |
C1 | C5 | N1 | C6 | 116.4° | 120.0° |
C1 | C5 | N1 | H4 | 121.6° | 120.0° |
C1 | C5 | C6 | H4 | 119.9° | 120.0° |
C1 | C5 | C6 | H5 | 45.7° | 176.6° |
C1 | C5 | C6 | H6 | 166.4° | 63.4° |
C5 | C1 | C2 | H22 | 66.1° | 62.3° |
C5 | C1 | O1 | H28 | 51.7° | 180.0° |
N1 | C7 | C8 | H7 | 120.4° | 120.1° |
N1 | C7 | C8 | H8 | 120.4° | 119.9° |
C7 | N1 | C5 | C6 | 56.8° | 54.2° |
N1 | C7 | C8 | C9 | 86.4° | 90.1° |
N1 | C7 | C8 | C25 | 88.8° | 89.7° |
C7 | N1 | C4 | H2 | 43.2° | 65.8° |
C7 | N1 | C4 | H3 | 76.5° | 54.1° |
C7 | N1 | C5 | H4 | 65.1° | 65.8° |
N1 | C7 | H7 | H8 | 118.8° | 120.0° |
C5 | N1 | C7 | C8 | 65.6° | 173.4° |
N1 | C5 | C6 | H4 | 122.6° | 120.0° |
C5 | N1 | C4 | H2 | 176.7° | 58.3° |
C5 | N1 | C4 | H3 | 57.0° | 178.2° |
N1 | C5 | C6 | H5 | 163.2° | 56.5° |
N1 | C5 | C6 | H6 | 76.1° | 176.6° |
C5 | N1 | C7 | H7 | 54.8° | 66.6° |
C5 | N1 | C7 | H8 | 174.0° | 53.4° |
N1 | C5 | C1 | H17 | 58.9° | 60.8° |
C7 | C8 | C9 | C25 | 175.4° | 179.8° |
C7 | C8 | C9 | C10 | 176.9° | 180.0° |
C7 | C8 | C25 | C24 | 178.6° | 180.0° |
C8 | C7 | H7 | H8 | 118.8° | 120.0° |
C7 | C8 | C25 | H24 | 1.4° | 0.0° |
C7 | C8 | C9 | H26 | 3.1° | 0.1° |
C5 | C6 | H5 | H6 | 121.0° | 120.0° |
C6 | C5 | C1 | H17 | 58.6° | 59.2° |
C5 | C6 | O4 | H31 | 180.0° | 179.9° |
C20 | C19 | N3 | H21 | 180.0° | 180.0° |
C19 | C20 | C21 | H13 | 180.0° | 180.0° |
C20 | C19 | N3 | C18 | 1.7° | 0.0° |
C19 | C20 | C21 | N4 | 0.7° | 0.0° |
C19 | C20 | C21 | H14 | 179.3° | 180.0° |
N3 | C19 | C20 | C21 | 0.9° | 0.0° |
C19 | N3 | C18 | N4 | 0.9° | 0.0° |
C19 | N3 | C18 | C17 | 178.0° | 180.0° |
N3 | C19 | C20 | H13 | 179.1° | 180.0° |
C20 | C21 | N4 | H14 | 180.0° | 180.0° |
C20 | C21 | N4 | C18 | 1.6° | 0.0° |
C21 | C20 | C19 | H21 | 179.1° | 180.0° |
C8 | C9 | C10 | H26 | 180.0° | 179.8° |
C9 | C8 | C25 | C24 | 3.1° | 0.2° |
C8 | C9 | C10 | C11 | 179.4° | 179.9° |
C8 | C9 | C10 | C23 | 0.9° | 0.1° |
C9 | C8 | C7 | H7 | 153.2° | 30.0° |
C9 | C8 | C7 | H8 | 34.0° | 150.0° |
C9 | C8 | C25 | H24 | 176.9° | 179.8° |
C25 | C8 | C9 | C10 | 1.5° | 0.2° |
C8 | C25 | C24 | H24 | 180.0° | 179.9° |
C8 | C25 | C24 | C23 | 4.2° | 0.0° |
C25 | C8 | C7 | H7 | 31.6° | 150.2° |
C25 | C8 | C7 | H8 | 150.8° | 30.2° |
C8 | C25 | C24 | H16 | 175.7° | 179.8° |
C25 | C8 | C9 | H26 | 178.5° | 179.7° |
C9 | C10 | C11 | C23 | 178.5° | 179.9° |
C9 | C10 | C11 | N2 | 160.1° | 90.1° |
C9 | C10 | C23 | C24 | 1.8° | 0.4° |
C9 | C10 | C11 | H18 | 39.7° | 30.0° |
C9 | C10 | C11 | H19 | 79.5° | 149.9° |
C9 | C10 | C23 | H23 | 178.2° | 179.9° |
N3 | C18 | N4 | C21 | 0.8° | 0.0° |
N3 | C18 | N4 | C17 | 178.9° | 180.0° |
N3 | C18 | C17 | C22 | 30.4° | 179.6° |
N3 | C18 | C17 | C16 | 148.1° | 0.1° |
C18 | N3 | C19 | H21 | 178.2° | 180.0° |
C21 | N4 | C18 | C17 | 179.7° | 180.0° |
N4 | C21 | C20 | H13 | 179.3° | 180.0° |
C25 | C24 | C23 | C10 | 3.5° | 0.3° |
C25 | C24 | C23 | H16 | 180.0° | 179.7° |
C25 | C24 | C23 | H23 | 176.5° | 180.0° |
C10 | C11 | N2 | H18 | 120.4° | 120.0° |
C10 | C11 | N2 | H19 | 120.4° | 120.0° |
C11 | C10 | C23 | C24 | 179.7° | 179.7° |
C10 | C11 | N2 | C12 | 62.8° | 180.0° |
C10 | C11 | H18 | H19 | 118.9° | 120.0° |
C11 | C10 | C23 | H23 | 0.3° | 0.0° |
C11 | C10 | C9 | H26 | 0.6° | 0.1° |
C10 | C11 | N2 | H27 | 175.7° | 0.0° |
C23 | C10 | C11 | N2 | 21.4° | 90.0° |
C10 | C23 | C24 | H23 | 180.0° | 179.7° |
C10 | C23 | C24 | H16 | 176.5° | 179.9° |
C23 | C10 | C11 | H18 | 141.8° | 149.9° |
C23 | C10 | C11 | H19 | 98.9° | 30.0° |
C23 | C10 | C9 | H26 | 179.1° | 180.0° |
C11 | N2 | C12 | C22 | 20.2° | 0.0° |
C11 | N2 | C12 | H27 | 121.5° | 180.0° |
C11 | N2 | C12 | C13 | 158.8° | 180.0° |
N2 | C11 | H18 | H19 | 118.9° | 120.0° |
N4 | C18 | C17 | C22 | 150.7° | 0.5° |
N4 | C18 | C17 | C16 | 30.8° | 180.0° |
C18 | N4 | C21 | H14 | 178.5° | 180.0° |
C18 | C17 | C22 | C16 | 178.5° | 179.5° |
C18 | C17 | C22 | C12 | 178.5° | 179.7° |
C18 | C17 | C16 | C14 | 178.9° | 180.0° |
C18 | C17 | C22 | H15 | 1.4° | 0.5° |
C18 | C17 | C16 | H20 | 1.1° | 0.5° |
C17 | C22 | C12 | H15 | 180.0° | 179.2° |
C17 | C22 | C12 | N2 | 178.9° | 179.4° |
C17 | C22 | C12 | C13 | 0.0° | 0.5° |
C22 | C17 | C16 | C14 | 0.4° | 0.5° |
C22 | C17 | C16 | H20 | 179.6° | 180.0° |
C12 | C22 | C17 | C16 | 0.1° | 0.8° |
C22 | C12 | N2 | C13 | 179.0° | 180.0° |
C22 | C12 | C13 | C14 | 0.3° | 0.0° |
C22 | C12 | C13 | H9 | 179.7° | 179.7° |
C22 | C12 | N2 | H27 | 101.3° | 180.0° |
C23 | C24 | C25 | H24 | 175.8° | 179.9° |
C17 | C16 | C14 | H20 | 180.0° | 179.5° |
C17 | C16 | C14 | C13 | 0.6° | 0.0° |
C17 | C16 | C14 | C15 | 179.8° | 180.0° |
C16 | C17 | C22 | H15 | 179.9° | 180.0° |
N2 | C12 | C13 | C14 | 178.6° | 180.0° |
N2 | C12 | C13 | H9 | 1.3° | 0.3° |
N2 | C12 | C22 | H15 | 1.1° | 0.2° |
C12 | N2 | C11 | H18 | 57.5° | 60.0° |
C12 | N2 | C11 | H19 | 176.8° | 60.0° |
C12 | C13 | C14 | C16 | 0.6° | 0.3° |
C12 | C13 | C14 | H9 | 180.0° | 179.7° |
C12 | C13 | C14 | C15 | 179.8° | 179.8° |
C13 | C12 | C22 | H15 | 179.9° | 179.8° |
C13 | C12 | N2 | H27 | 79.8° | 0.0° |
C16 | C14 | C13 | C15 | 179.6° | 180.0° |
C16 | C14 | C13 | H9 | 179.4° | 180.0° |
C16 | C14 | C15 | H10 | 89.8° | 90.0° |
C16 | C14 | C15 | H11 | 150.2° | 30.0° |
C16 | C14 | C15 | H12 | 30.2° | 150.0° |
C13 | C14 | C15 | H10 | 89.8° | 90.0° |
C13 | C14 | C15 | H11 | 30.2° | 150.0° |
C13 | C14 | C15 | H12 | 150.2° | 30.0° |
C13 | C14 | C16 | H20 | 179.4° | 179.4° |
C15 | C14 | C13 | H9 | 0.2° | 0.0° |
C14 | C15 | H10 | H11 | 120.0° | 120.0° |
C14 | C15 | H10 | H12 | 120.0° | 120.0° |
C14 | C15 | H11 | H12 | 120.0° | 120.0° |
C15 | C14 | C16 | H20 | 0.2° | 0.5° |
H2 | C4 | C3 | H25 | 66.1° | 179.2° |
H3 | C4 | C3 | H25 | 174.1° | 59.3° |
H4 | C5 | C6 | H5 | 74.1° | 63.5° |
H4 | C5 | C6 | H6 | 46.5° | 56.6° |
H4 | C5 | C1 | H17 | 178.7° | 179.2° |
H5 | C6 | O4 | H31 | 60.3° | 60.1° |
H6 | C6 | O4 | H31 | 60.3° | 60.0° |
H10 | C15 | H11 | H12 | 120.0° | 120.0° |
H13 | C20 | C21 | H14 | 0.7° | 0.1° |
H13 | C20 | C19 | H21 | 0.9° | 0.0° |
H16 | C24 | C23 | H23 | 3.5° | 0.3° |
H16 | C24 | C25 | H24 | 4.2° | 0.2° |
H17 | C1 | C2 | H22 | 178.4° | 177.8° |
H17 | C1 | O1 | H28 | 64.5° | 59.9° |
H18 | C11 | N2 | H27 | 63.9° | 120.0° |
H19 | C11 | N2 | H27 | 55.4° | 120.0° |
H22 | C2 | C3 | H25 | 178.7° | 177.8° |
H22 | C2 | O2 | H29 | 60.7° | 59.9° |
H25 | C3 | O3 | H30 | 61.1° | 59.9° |