N0N
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O11 | C2 | sing | 1.43Å | 1.43Å | |
O10 | C6 | sing | 1.43Å | 1.47Å | |
O12 | C3 | sing | 1.43Å | 1.43Å | |
C3 | C2 | sing | 1.54Å | 1.52Å | |
C3 | C4 | sing | 1.54Å | 1.54Å | |
N7 | C4 | sing | 1.47Å | 1.49Å | |
N7 | C15 | sing | 1.47Å | 1.47Å | |
C16 | C15 | sing | 1.53Å | 1.53Å | |
C16 | C17 | sing | 1.53Å | 1.53Å | |
C2 | C6 | sing | 1.55Å | 1.52Å | |
C6 | C5 | sing | 1.55Å | 1.52Å | |
C18 | C17 | sing | 1.53Å | 1.51Å | |
C18 | C19 | sing | 1.53Å | 1.53Å | |
C4 | C5 | sing | 1.54Å | 1.55Å | |
C19 | C20 | sing | 1.53Å | 1.54Å | |
C5 | C8 | sing | 1.53Å | 1.54Å | |
C8 | O9 | sing | 1.43Å | 1.47Å | |
C20 | N21 | sing | 1.46Å | 1.48Å | |
N21 | S1 | sing | 1.66Å | 1.62Å | |
C22 | C23 | doub | 1.36Å | 1.40Å | Aromatic |
C22 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
C23 | C9 | sing | 1.41Å | 1.39Å | Aromatic |
C21 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
S1 | O4 | doub | 1.42Å | 1.45Å | |
S1 | O2 | doub | 1.42Å | 1.42Å | |
S1 | C7 | sing | 1.76Å | 1.62Å | |
C9 | C7 | doub | 1.40Å | 1.50Å | Aromatic |
C9 | C10 | sing | 1.42Å | 1.49Å | Aromatic |
C25 | N24 | sing | 1.47Å | 1.46Å | |
C7 | C13 | sing | 1.36Å | 1.39Å | Aromatic |
C14 | C10 | sing | 1.41Å | 1.49Å | Aromatic |
C14 | N24 | sing | 1.39Å | 1.41Å | |
C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
N24 | C26 | sing | 1.47Å | 1.45Å | |
C13 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
C11 | C12 | sing | 1.36Å | 1.38Å | Aromatic |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C5 | H2 | sing | 1.09Å | 1.10Å | |
C6 | H3 | sing | 1.09Å | 1.10Å | |
C8 | H4 | sing | 1.09Å | 1.10Å | |
C8 | H5 | sing | 1.09Å | 1.10Å | |
C11 | H6 | sing | 1.08Å | 1.08Å | |
C12 | H7 | sing | 1.08Å | 1.08Å | |
C13 | H8 | sing | 1.08Å | 1.08Å | |
C15 | H9 | sing | 1.09Å | 1.10Å | |
C15 | H10 | sing | 1.09Å | 1.10Å | |
C2 | H11 | sing | 1.09Å | 1.10Å | |
C3 | H12 | sing | 1.09Å | 1.10Å | |
N7 | H13 | sing | 1.01Å | 1.00Å | |
O9 | H15 | sing | 0.97Å | 0.95Å | |
O10 | H16 | sing | 0.97Å | 0.95Å | |
O11 | H17 | sing | 0.97Å | 0.95Å | |
O12 | H18 | sing | 0.97Å | 0.95Å | |
C16 | H19 | sing | 1.09Å | 1.10Å | |
C16 | H20 | sing | 1.09Å | 1.10Å | |
C17 | H21 | sing | 1.09Å | 1.10Å | |
C17 | H22 | sing | 1.09Å | 1.10Å | |
C18 | H23 | sing | 1.09Å | 1.10Å | |
C18 | H24 | sing | 1.09Å | 1.10Å | |
C19 | H25 | sing | 1.09Å | 1.10Å | |
C19 | H26 | sing | 1.09Å | 1.10Å | |
C20 | H27 | sing | 1.09Å | 1.10Å | |
C20 | H28 | sing | 1.09Å | 1.10Å | |
N21 | H29 | sing | 0.97Å | 1.00Å | |
C21 | H30 | sing | 1.08Å | 1.08Å | |
C22 | H31 | sing | 1.08Å | 1.08Å | |
C23 | H32 | sing | 1.08Å | 1.08Å | |
C25 | H33 | sing | 1.09Å | 1.10Å | |
C25 | H34 | sing | 1.09Å | 1.10Å | |
C25 | H35 | sing | 1.09Å | 1.10Å | |
C26 | H36 | sing | 1.09Å | 1.10Å | |
C26 | H37 | sing | 1.09Å | 1.10Å | |
C26 | H38 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O11 | C2 | C3 | 115.0° | 110.6° |
O11 | C2 | C6 | 112.5° | 110.5° |
O11 | C2 | H11 | 110.2° | 110.4° |
C2 | O11 | H17 | 109.5° | 113.9° |
O10 | C6 | C2 | 108.3° | 111.0° |
O10 | C6 | C5 | 109.7° | 110.7° |
O10 | C6 | H3 | 113.0° | 110.7° |
C6 | O10 | H16 | 109.5° | 114.0° |
O12 | C3 | C2 | 110.5° | 110.0° |
O12 | C3 | C4 | 117.0° | 110.0° |
O12 | C3 | H12 | 109.3° | 110.0° |
C3 | O12 | H18 | 109.5° | 114.0° |
C2 | C3 | C4 | 103.7° | 106.6° |
C3 | C2 | C6 | 100.9° | 104.2° |
C3 | C2 | H11 | 108.9° | 110.5° |
C2 | C3 | H12 | 108.0° | 110.0° |
C3 | C4 | N7 | 109.6° | 110.1° |
C3 | C4 | C5 | 105.2° | 106.6° |
C3 | C4 | H1 | 109.0° | 110.1° |
C4 | C3 | H12 | 107.9° | 110.1° |
C4 | N7 | C15 | 111.7° | 111.0° |
N7 | C4 | C5 | 114.6° | 110.0° |
N7 | C4 | H1 | 109.6° | 110.0° |
C4 | N7 | H13 | 108.9° | 111.0° |
N7 | C15 | C16 | 112.5° | 109.5° |
N7 | C15 | H9 | 108.7° | 109.5° |
N7 | C15 | H10 | 108.7° | 109.5° |
C15 | N7 | H13 | 108.9° | 111.0° |
C15 | C16 | C17 | 108.9° | 109.5° |
C16 | C15 | H9 | 108.7° | 109.4° |
C16 | C15 | H10 | 108.7° | 109.4° |
C15 | C16 | H19 | 109.6° | 109.4° |
C15 | C16 | H20 | 109.6° | 109.5° |
C16 | C17 | C18 | 113.0° | 109.5° |
C17 | C16 | H19 | 109.6° | 109.5° |
C17 | C16 | H20 | 109.6° | 109.5° |
C16 | C17 | H21 | 108.6° | 109.4° |
C16 | C17 | H22 | 108.6° | 109.5° |
C2 | C6 | C5 | 100.6° | 102.8° |
C2 | C6 | H3 | 112.2° | 110.8° |
C6 | C2 | H11 | 108.8° | 110.5° |
C6 | C5 | C4 | 103.7° | 104.2° |
C6 | C5 | C8 | 112.2° | 110.5° |
C6 | C5 | H2 | 107.5° | 110.6° |
C5 | C6 | H3 | 112.3° | 110.7° |
C17 | C18 | C19 | 113.8° | 109.5° |
C18 | C17 | H21 | 108.6° | 109.4° |
C18 | C17 | H22 | 108.6° | 109.5° |
C17 | C18 | H23 | 108.4° | 109.5° |
C17 | C18 | H24 | 108.4° | 109.5° |
C18 | C19 | C20 | 114.8° | 109.5° |
C19 | C18 | H23 | 108.4° | 109.5° |
C19 | C18 | H24 | 108.4° | 109.4° |
C18 | C19 | H25 | 108.1° | 109.5° |
C18 | C19 | H26 | 108.1° | 109.4° |
C4 | C5 | C8 | 118.5° | 110.5° |
C5 | C4 | H1 | 108.8° | 110.0° |
C4 | C5 | H2 | 107.1° | 110.5° |
C19 | C20 | N21 | 109.0° | 109.5° |
C20 | C19 | H25 | 108.1° | 109.5° |
C20 | C19 | H26 | 108.1° | 109.5° |
C19 | C20 | H27 | 109.6° | 109.5° |
C19 | C20 | H28 | 109.6° | 109.5° |
C5 | C8 | O9 | 109.5° | 109.5° |
C8 | C5 | H2 | 107.3° | 110.4° |
C5 | C8 | H4 | 109.4° | 109.4° |
C5 | C8 | H5 | 109.4° | 109.4° |
O9 | C8 | H4 | 109.5° | 109.5° |
O9 | C8 | H5 | 109.4° | 109.5° |
C8 | O9 | H15 | 109.5° | 114.0° |
C20 | N21 | S1 | 114.2° | 120.0° |
N21 | C20 | H27 | 109.6° | 109.5° |
N21 | C20 | H28 | 109.6° | 109.5° |
C20 | N21 | H29 | 108.3° | 120.0° |
N21 | S1 | O4 | 107.7° | 106.4° |
N21 | S1 | O2 | 110.8° | 106.4° |
N21 | S1 | C7 | 112.0° | 107.2° |
S1 | N21 | H29 | 108.3° | 120.0° |
C23 | C22 | C21 | 122.4° | 121.0° |
C22 | C23 | C9 | 120.8° | 120.0° |
C23 | C22 | H31 | 118.8° | 119.5° |
C22 | C23 | H32 | 119.6° | 120.0° |
C22 | C21 | C14 | 121.3° | 120.8° |
C22 | C21 | H30 | 119.4° | 119.6° |
C21 | C22 | H31 | 118.8° | 119.4° |
C23 | C9 | C7 | 123.0° | 121.2° |
C23 | C9 | C10 | 118.5° | 119.4° |
C9 | C23 | H32 | 119.6° | 120.0° |
C21 | C14 | C10 | 118.1° | 119.4° |
C21 | C14 | N24 | 121.0° | 120.3° |
C14 | C21 | H30 | 119.3° | 119.6° |
O4 | S1 | O2 | 108.9° | 123.2° |
O4 | S1 | C7 | 108.9° | 106.4° |
O2 | S1 | C7 | 108.5° | 106.4° |
S1 | C7 | C9 | 124.1° | 120.2° |
S1 | C7 | C13 | 119.8° | 120.1° |
C7 | C9 | C10 | 118.5° | 119.4° |
C9 | C7 | C13 | 116.1° | 119.7° |
C9 | C10 | C14 | 118.8° | 119.4° |
C9 | C10 | C11 | 120.4° | 119.4° |
C25 | N24 | C14 | 119.9° | 111.0° |
C25 | N24 | C26 | 119.4° | 111.0° |
N24 | C25 | H33 | 109.5° | 109.5° |
N24 | C25 | H34 | 109.5° | 109.4° |
N24 | C25 | H35 | 109.5° | 109.5° |
C7 | C13 | C12 | 123.2° | 121.0° |
C7 | C13 | H8 | 118.4° | 119.5° |
C10 | C14 | N24 | 120.9° | 120.4° |
C14 | C10 | C11 | 120.7° | 121.2° |
C14 | N24 | C26 | 120.7° | 111.0° |
C10 | C11 | C12 | 119.5° | 119.7° |
C10 | C11 | H6 | 120.2° | 120.2° |
N24 | C26 | H36 | 109.5° | 109.5° |
N24 | C26 | H37 | 109.5° | 109.4° |
N24 | C26 | H38 | 109.5° | 109.4° |
C13 | C12 | C11 | 122.3° | 120.9° |
C13 | C12 | H7 | 118.8° | 119.6° |
C12 | C13 | H8 | 118.4° | 119.5° |
C12 | C11 | H6 | 120.2° | 120.1° |
C11 | C12 | H7 | 118.9° | 119.5° |
H4 | C8 | H5 | 109.5° | 109.5° |
H9 | C15 | H10 | 109.5° | 109.4° |
H19 | C16 | H20 | 109.5° | 109.4° |
H21 | C17 | H22 | 109.4° | 109.5° |
H23 | C18 | H24 | 109.5° | 109.5° |
H25 | C19 | H26 | 109.5° | 109.5° |
H27 | C20 | H28 | 109.5° | 109.5° |
H33 | C25 | H34 | 109.5° | 109.5° |
H33 | C25 | H35 | 109.5° | 109.5° |
H34 | C25 | H35 | 109.4° | 109.5° |
H36 | C26 | H37 | 109.5° | 109.5° |
H36 | C26 | H38 | 109.5° | 109.5° |
H37 | C26 | H38 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O11 | C2 | C6 | O10 | 59.1° | 38.4° |
O11 | C2 | C3 | O12 | 71.3° | 98.4° |
O11 | C2 | C3 | C6 | 121.3° | 118.7° |
O11 | C2 | C3 | H11 | 124.2° | 122.6° |
O11 | C2 | C3 | C4 | 162.5° | 142.3° |
O11 | C2 | C6 | H11 | 122.4° | 122.5° |
O11 | C2 | C6 | C5 | 174.1° | 156.8° |
O11 | C2 | C6 | H3 | 66.3° | 85.0° |
O11 | C2 | C3 | H12 | 48.2° | 23.0° |
O10 | C6 | C2 | C3 | 64.0° | 80.4° |
O10 | C6 | C2 | C5 | 115.0° | 118.4° |
O10 | C6 | C2 | H3 | 125.5° | 123.4° |
O10 | C6 | C5 | H3 | 126.6° | 123.1° |
O10 | C6 | C5 | C4 | 73.3° | 80.6° |
O10 | C6 | C5 | C8 | 55.8° | 38.1° |
O10 | C6 | C5 | H2 | 173.5° | 160.7° |
O10 | C6 | C2 | H11 | 178.5° | 160.9° |
O12 | C3 | C2 | C4 | 126.2° | 119.3° |
O12 | C3 | C2 | H12 | 119.5° | 121.4° |
O12 | C3 | C4 | H12 | 123.6° | 121.4° |
O12 | C3 | C4 | N7 | 98.5° | 121.4° |
O12 | C3 | C2 | C6 | 167.4° | 142.9° |
O12 | C3 | C4 | C5 | 137.9° | 119.3° |
O12 | C3 | C4 | H1 | 21.4° | 0.0° |
O12 | C3 | C2 | H11 | 52.9° | 24.2° |
C2 | C3 | C4 | H12 | 114.4° | 119.3° |
C2 | C3 | C4 | N7 | 139.5° | 119.3° |
C3 | C2 | C6 | H11 | 114.5° | 118.7° |
C3 | C2 | C6 | C5 | 51.0° | 38.0° |
C2 | C3 | C4 | C5 | 15.9° | 0.0° |
C2 | C3 | C4 | H1 | 100.5° | 119.2° |
C3 | C2 | C6 | H3 | 170.5° | 156.2° |
C3 | C2 | O11 | H17 | 180.0° | 65.2° |
C2 | C3 | O12 | H18 | 180.0° | 61.5° |
C3 | C4 | N7 | C5 | 117.9° | 117.2° |
C3 | C4 | N7 | H1 | 119.6° | 121.5° |
C3 | C4 | N7 | C15 | 151.7° | 87.8° |
C4 | C3 | C2 | C6 | 41.2° | 23.7° |
C3 | C4 | C5 | C6 | 15.4° | 23.6° |
C3 | C4 | C5 | H1 | 116.6° | 119.3° |
C3 | C4 | C5 | C8 | 140.5° | 142.3° |
C3 | C4 | C5 | H2 | 98.1° | 95.2° |
C4 | C3 | C2 | H11 | 73.2° | 95.1° |
C3 | C4 | N7 | H13 | 88.0° | 148.2° |
C4 | C3 | O12 | H18 | 61.7° | 178.6° |
C4 | N7 | C15 | H13 | 120.3° | 123.9° |
C4 | N7 | C15 | C16 | 173.0° | 180.0° |
N7 | C4 | C5 | C6 | 105.0° | 95.8° |
N7 | C4 | C5 | H1 | 123.0° | 121.3° |
N7 | C4 | C5 | C8 | 20.1° | 22.9° |
N7 | C4 | C5 | H2 | 141.5° | 145.5° |
C4 | N7 | C15 | H9 | 66.6° | 60.0° |
C4 | N7 | C15 | H10 | 52.5° | 60.0° |
N7 | C4 | C3 | H12 | 25.1° | 0.0° |
N7 | C15 | C16 | H9 | 120.5° | 120.0° |
N7 | C15 | C16 | H10 | 120.5° | 120.0° |
N7 | C15 | C16 | C17 | 178.5° | 180.0° |
C15 | N7 | C4 | C5 | 90.4° | 155.0° |
C15 | N7 | C4 | H1 | 32.2° | 33.6° |
N7 | C15 | H9 | H10 | 118.6° | 120.0° |
N7 | C15 | C16 | H19 | 58.5° | 60.0° |
N7 | C15 | C16 | H20 | 61.7° | 60.0° |
C15 | C16 | C17 | H19 | 119.9° | 120.0° |
C15 | C16 | C17 | H20 | 119.9° | 120.0° |
C15 | C16 | C17 | C18 | 154.4° | 180.0° |
C16 | C15 | H9 | H10 | 118.6° | 119.9° |
C16 | C15 | N7 | H13 | 52.6° | 56.1° |
C15 | C16 | H19 | H20 | 120.3° | 120.0° |
C15 | C16 | C17 | H21 | 85.0° | 60.1° |
C15 | C16 | C17 | H22 | 33.9° | 60.0° |
C16 | C17 | C18 | H21 | 120.5° | 119.9° |
C16 | C17 | C18 | H22 | 120.5° | 120.0° |
C16 | C17 | C18 | C19 | 154.3° | 180.0° |
C17 | C16 | C15 | H9 | 61.1° | 60.0° |
C17 | C16 | C15 | H10 | 58.0° | 59.9° |
C17 | C16 | H19 | H20 | 120.3° | 120.0° |
C16 | C17 | H21 | H22 | 118.4° | 120.0° |
C16 | C17 | C18 | H23 | 85.1° | 60.0° |
C16 | C17 | C18 | H24 | 33.6° | 60.0° |
C2 | C6 | C5 | H3 | 119.5° | 118.3° |
C2 | C6 | C5 | C4 | 40.7° | 37.9° |
C2 | C6 | C5 | C8 | 169.7° | 156.6° |
C2 | C6 | C5 | H2 | 72.5° | 80.8° |
C6 | C2 | C3 | H12 | 73.1° | 95.7° |
C2 | C6 | O10 | H16 | 180.0° | 66.6° |
C6 | C2 | O11 | H17 | 65.2° | 180.0° |
C6 | C5 | C4 | C8 | 125.1° | 118.7° |
C6 | C5 | C4 | H2 | 113.5° | 118.8° |
C6 | C5 | C8 | H2 | 117.9° | 122.7° |
C6 | C5 | C8 | O9 | 64.2° | 70.2° |
C6 | C5 | C4 | H1 | 132.1° | 142.9° |
C6 | C5 | C8 | H4 | 55.8° | 49.7° |
C6 | C5 | C8 | H5 | 175.8° | 169.8° |
C5 | C6 | C2 | H11 | 63.5° | 80.8° |
C5 | C6 | O10 | H16 | 71.1° | 180.0° |
C17 | C18 | C19 | H23 | 120.6° | 120.0° |
C17 | C18 | C19 | H24 | 120.6° | 120.0° |
C17 | C18 | C19 | C20 | 75.6° | 180.0° |
C18 | C17 | C16 | H19 | 34.5° | 60.0° |
C18 | C17 | C16 | H20 | 85.7° | 60.0° |
C18 | C17 | H21 | H22 | 118.4° | 120.0° |
C17 | C18 | H23 | H24 | 118.0° | 120.0° |
C17 | C18 | C19 | H25 | 163.6° | 60.0° |
C17 | C18 | C19 | H26 | 45.1° | 60.0° |
C18 | C19 | C20 | H25 | 120.8° | 120.0° |
C18 | C19 | C20 | H26 | 120.8° | 120.0° |
C18 | C19 | C20 | N21 | 162.5° | 180.0° |
C19 | C18 | C17 | H21 | 33.7° | 60.0° |
C19 | C18 | C17 | H22 | 85.2° | 60.0° |
C19 | C18 | H23 | H24 | 118.0° | 120.0° |
C18 | C19 | H25 | H26 | 117.6° | 120.0° |
C18 | C19 | C20 | H27 | 77.6° | 60.0° |
C18 | C19 | C20 | H28 | 42.5° | 60.0° |
C4 | C5 | C8 | H2 | 121.3° | 122.6° |
C4 | C5 | C8 | O9 | 174.9° | 175.0° |
C4 | C5 | C6 | H3 | 160.2° | 156.3° |
C4 | C5 | C8 | H4 | 65.0° | 65.0° |
C4 | C5 | C8 | H5 | 55.0° | 55.0° |
C5 | C4 | C3 | H12 | 98.5° | 119.3° |
C5 | C4 | N7 | H13 | 29.9° | 31.0° |
C19 | C20 | N21 | H27 | 119.9° | 120.0° |
C19 | C20 | N21 | H28 | 119.9° | 120.0° |
C19 | C20 | N21 | S1 | 175.5° | 163.8° |
C20 | C19 | C18 | H23 | 45.0° | 60.0° |
C20 | C19 | C18 | H24 | 163.7° | 60.0° |
C20 | C19 | H25 | H26 | 117.6° | 120.0° |
C19 | C20 | H27 | H28 | 120.2° | 120.0° |
C19 | C20 | N21 | H29 | 63.8° | 16.2° |
C5 | C8 | O9 | H4 | 120.0° | 120.0° |
C5 | C8 | O9 | H5 | 120.0° | 120.0° |
C8 | C5 | C4 | H1 | 102.9° | 98.4° |
C8 | C5 | C6 | H3 | 70.8° | 85.0° |
C5 | C8 | H4 | H5 | 120.0° | 120.0° |
C5 | C8 | O9 | H15 | 180.0° | 179.9° |
O9 | C8 | C5 | H2 | 53.6° | 52.4° |
O9 | C8 | H4 | H5 | 120.0° | 120.0° |
C20 | N21 | S1 | H29 | 120.7° | 180.0° |
C20 | N21 | S1 | O4 | 162.9° | 49.6° |
C20 | N21 | S1 | O2 | 43.9° | 177.5° |
C20 | N21 | S1 | C7 | 77.4° | 64.0° |
N21 | C20 | C19 | H25 | 41.7° | 60.0° |
N21 | C20 | C19 | H26 | 76.8° | 60.0° |
N21 | C20 | H27 | H28 | 120.2° | 120.0° |
N21 | S1 | O4 | O2 | 120.2° | 122.9° |
N21 | S1 | O4 | C7 | 121.7° | 114.1° |
N21 | S1 | O2 | C7 | 123.4° | 114.1° |
N21 | S1 | C7 | C9 | 67.7° | 64.3° |
N21 | S1 | C7 | C13 | 112.9° | 116.0° |
S1 | N21 | C20 | H27 | 55.5° | 43.8° |
S1 | N21 | C20 | H28 | 64.6° | 76.2° |
C23 | C22 | C21 | H31 | 180.0° | 179.9° |
C22 | C23 | C9 | H32 | 180.0° | 179.9° |
C23 | C22 | C21 | C14 | 0.0° | 0.1° |
C22 | C23 | C9 | C7 | 179.7° | 180.0° |
C22 | C23 | C9 | C10 | 0.7° | 0.1° |
C23 | C22 | C21 | H30 | 180.0° | 180.0° |
C21 | C22 | C23 | C9 | 0.7° | 0.1° |
C22 | C21 | C14 | H30 | 180.0° | 179.9° |
C22 | C21 | C14 | C10 | 0.6° | 0.0° |
C22 | C21 | C14 | N24 | 179.7° | 180.0° |
C21 | C22 | C23 | H32 | 179.3° | 180.0° |
C23 | C9 | C7 | S1 | 1.1° | 0.3° |
C23 | C9 | C7 | C10 | 179.0° | 179.9° |
C23 | C9 | C7 | C13 | 179.5° | 180.0° |
C23 | C9 | C10 | C14 | 0.1° | 0.1° |
C23 | C9 | C10 | C11 | 178.8° | 180.0° |
C9 | C23 | C22 | H31 | 179.3° | 180.0° |
C21 | C14 | C10 | C9 | 0.5° | 0.0° |
C21 | C14 | N24 | C25 | 48.0° | 64.0° |
C21 | C14 | C10 | N24 | 179.7° | 180.0° |
C21 | C14 | C10 | C11 | 179.4° | 180.0° |
C21 | C14 | N24 | C26 | 131.1° | 60.0° |
C14 | C21 | C22 | H31 | 180.0° | 180.0° |
O4 | S1 | O2 | C7 | 118.3° | 123.0° |
O4 | S1 | C7 | C9 | 51.3° | 177.8° |
O4 | S1 | C7 | C13 | 128.0° | 2.4° |
O4 | S1 | N21 | H29 | 76.4° | 130.5° |
O2 | S1 | C7 | C9 | 169.7° | 49.2° |
O2 | S1 | C7 | C13 | 9.7° | 130.5° |
O2 | S1 | N21 | H29 | 164.6° | 2.4° |
S1 | C7 | C9 | C13 | 179.4° | 179.7° |
S1 | C7 | C9 | C10 | 179.8° | 179.7° |
S1 | C7 | C13 | C12 | 179.9° | 179.7° |
S1 | C7 | C13 | H8 | 0.2° | 0.2° |
C7 | S1 | N21 | H29 | 43.3° | 116.0° |
C7 | C9 | C10 | C14 | 179.2° | 180.0° |
C7 | C9 | C10 | C11 | 0.3° | 0.0° |
C9 | C7 | C13 | C12 | 0.4° | 0.0° |
C9 | C7 | C13 | H8 | 179.6° | 179.9° |
C7 | C9 | C23 | H32 | 0.3° | 0.0° |
C10 | C9 | C7 | C13 | 0.4° | 0.0° |
C9 | C10 | C14 | C11 | 178.9° | 180.0° |
C9 | C10 | C14 | N24 | 179.7° | 180.0° |
C9 | C10 | C11 | C12 | 1.0° | 0.1° |
C9 | C10 | C11 | H6 | 179.1° | 180.0° |
C10 | C9 | C23 | H32 | 179.3° | 180.0° |
C25 | N24 | C14 | C10 | 132.3° | 116.0° |
C25 | N24 | C14 | C26 | 179.1° | 124.0° |
N24 | C25 | H33 | H34 | 120.0° | 120.0° |
N24 | C25 | H33 | H35 | 120.0° | 120.0° |
N24 | C25 | H34 | H35 | 120.0° | 120.0° |
C25 | N24 | C26 | H36 | 180.0° | 176.1° |
C25 | N24 | C26 | H37 | 60.0° | 56.0° |
C25 | N24 | C26 | H38 | 60.0° | 64.0° |
C7 | C13 | C12 | H8 | 180.0° | 180.0° |
C7 | C13 | C12 | C11 | 0.3° | 0.0° |
C7 | C13 | C12 | H7 | 179.8° | 180.0° |
C10 | C14 | N24 | C26 | 48.6° | 120.0° |
C14 | C10 | C11 | C12 | 179.9° | 180.0° |
C14 | C10 | C11 | H6 | 0.2° | 0.0° |
C10 | C14 | C21 | H30 | 179.4° | 180.0° |
N24 | C14 | C10 | C11 | 0.8° | 0.0° |
N24 | C14 | C21 | H30 | 0.3° | 0.0° |
C14 | N24 | C25 | H33 | 180.0° | 60.0° |
C14 | N24 | C25 | H34 | 60.0° | 180.0° |
C14 | N24 | C25 | H35 | 60.0° | 60.0° |
C14 | N24 | C26 | H36 | 0.9° | 60.0° |
C14 | N24 | C26 | H37 | 120.9° | 180.0° |
C14 | N24 | C26 | H38 | 119.1° | 60.0° |
C10 | C11 | C12 | C13 | 1.0° | 0.1° |
C10 | C11 | C12 | H6 | 180.0° | 179.9° |
C10 | C11 | C12 | H7 | 179.0° | 180.0° |
C26 | N24 | C25 | H33 | 0.9° | 63.9° |
C26 | N24 | C25 | H34 | 120.9° | 56.0° |
C26 | N24 | C25 | H35 | 119.1° | 176.1° |
N24 | C26 | H36 | H37 | 120.0° | 120.0° |
N24 | C26 | H36 | H38 | 120.0° | 120.0° |
N24 | C26 | H37 | H38 | 120.0° | 120.0° |
C13 | C12 | C11 | H7 | 180.0° | 180.0° |
C13 | C12 | C11 | H6 | 179.0° | 180.0° |
C11 | C12 | C13 | H8 | 179.7° | 179.9° |
H1 | C4 | C5 | H2 | 18.5° | 24.1° |
H1 | C4 | C3 | H12 | 145.0° | 121.4° |
H1 | C4 | N7 | H13 | 152.5° | 90.3° |
H2 | C5 | C6 | H3 | 47.0° | 37.6° |
H2 | C5 | C8 | H4 | 173.6° | 172.4° |
H2 | C5 | C8 | H5 | 66.4° | 67.6° |
H3 | C6 | C2 | H11 | 56.1° | 37.5° |
H3 | C6 | O10 | H16 | 55.0° | 56.8° |
H4 | C8 | O9 | H15 | 60.0° | 60.0° |
H5 | C8 | O9 | H15 | 60.0° | 60.1° |
H6 | C11 | C12 | H7 | 0.9° | 0.0° |
H7 | C12 | C13 | H8 | 0.3° | 0.0° |
H9 | C15 | N7 | H13 | 173.1° | 176.1° |
H9 | C15 | C16 | H19 | 179.0° | 180.0° |
H9 | C15 | C16 | H20 | 58.8° | 60.1° |
H10 | C15 | N7 | H13 | 67.8° | 63.9° |
H10 | C15 | C16 | H19 | 61.9° | 60.1° |
H10 | C15 | C16 | H20 | 177.9° | 180.0° |
H11 | C2 | C3 | H12 | 172.5° | 145.6° |
H11 | C2 | O11 | H17 | 56.4° | 57.5° |
H12 | C3 | O12 | H18 | 61.2° | 59.9° |
H19 | C16 | C17 | H21 | 155.1° | 179.9° |
H19 | C16 | C17 | H22 | 86.0° | 60.0° |
H20 | C16 | C17 | H21 | 34.9° | 60.0° |
H20 | C16 | C17 | H22 | 153.8° | 180.0° |
H21 | C17 | C18 | H23 | 154.4° | 180.0° |
H21 | C17 | C18 | H24 | 86.9° | 60.0° |
H22 | C17 | C18 | H23 | 35.4° | 60.0° |
H22 | C17 | C18 | H24 | 154.2° | 180.0° |
H23 | C18 | C19 | H25 | 75.8° | 180.0° |
H23 | C18 | C19 | H26 | 165.7° | 60.0° |
H24 | C18 | C19 | H25 | 42.9° | 60.0° |
H24 | C18 | C19 | H26 | 75.5° | 180.0° |
H25 | C19 | C20 | H27 | 161.6° | 180.0° |
H25 | C19 | C20 | H28 | 78.3° | 60.0° |
H26 | C19 | C20 | H27 | 43.1° | 60.0° |
H26 | C19 | C20 | H28 | 163.3° | 180.0° |
H27 | C20 | N21 | H29 | 176.3° | 136.2° |
H28 | C20 | N21 | H29 | 56.1° | 103.8° |
H30 | C21 | C22 | H31 | 0.0° | 0.1° |
H31 | C22 | C23 | H32 | 0.7° | 0.0° |
H33 | C25 | H34 | H35 | 120.0° | 120.0° |
H36 | C26 | H37 | H38 | 120.0° | 120.0° |