163
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | C | doub | 1.31Å | 1.33Å | |
N | H | sing | 0.97Å | 1.00Å | |
C | N1 | sing | 1.38Å | 1.33Å | |
C | C1 | sing | 1.47Å | 1.49Å | |
N1 | H11A | sing | 0.97Å | 1.00Å | |
N1 | H12 | sing | 0.97Å | 1.00Å | |
C1 | N2 | sing | 1.37Å | 1.39Å | Aromatic |
C1 | C3 | doub | 1.37Å | 1.37Å | Aromatic |
N2 | C2 | sing | 1.46Å | 1.49Å | |
N2 | C5 | sing | 1.36Å | 1.36Å | Aromatic |
C2 | H21 | sing | 1.09Å | 1.10Å | |
C2 | H22 | sing | 1.09Å | 1.10Å | |
C2 | H23 | sing | 1.09Å | 1.10Å | |
C3 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
C3 | H3 | sing | 1.08Å | 1.08Å | |
C4 | C5 | doub | 1.35Å | 1.34Å | Aromatic |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C5 | C6 | sing | 1.51Å | 1.51Å | |
C6 | N3 | sing | 1.47Å | 1.47Å | |
C6 | H61 | sing | 1.09Å | 1.10Å | |
C6 | H62 | sing | 1.09Å | 1.10Å | |
N3 | C7 | sing | 1.35Å | 1.36Å | |
N3 | HN3 | sing | 0.97Å | 1.00Å | |
C7 | O | doub | 1.22Å | 1.22Å | |
C7 | C8 | sing | 1.47Å | 1.52Å | |
C8 | C9 | doub | 1.37Å | 1.51Å | Aromatic |
C8 | N4 | sing | 1.38Å | 1.48Å | Aromatic |
C9 | C10 | sing | 1.40Å | 1.30Å | Aromatic |
C9 | H9 | sing | 1.08Å | 1.08Å | |
C10 | C11 | doub | 1.35Å | 1.51Å | Aromatic |
C10 | H10 | sing | 1.08Å | 1.08Å | |
C11 | N4 | sing | 1.36Å | 1.48Å | Aromatic |
C11 | H11 | sing | 1.08Å | 1.08Å | |
N4 | C12 | sing | 1.35Å | 1.38Å | |
C12 | O1 | doub | 1.21Å | 1.22Å | |
C12 | C13 | sing | 1.51Å | 1.52Å | |
C13 | C14 | sing | 1.53Å | 1.54Å | |
C13 | N5 | sing | 1.47Å | 1.47Å | |
C13 | H13 | sing | 1.09Å | 1.10Å | |
C14 | C15 | sing | 1.53Å | 1.54Å | |
C14 | H141 | sing | 1.09Å | 1.10Å | |
C14 | H142 | sing | 1.09Å | 1.10Å | |
C15 | C16 | sing | 1.53Å | 1.55Å | |
C15 | C20 | sing | 1.53Å | 1.55Å | |
C15 | H15 | sing | 1.09Å | 1.10Å | |
C16 | C17 | sing | 1.53Å | 1.55Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C17 | C18 | sing | 1.53Å | 1.55Å | |
C17 | H171 | sing | 1.09Å | 1.10Å | |
C17 | H172 | sing | 1.09Å | 1.10Å | |
C18 | C19 | sing | 1.53Å | 1.55Å | |
C18 | H181 | sing | 1.09Å | 1.10Å | |
C18 | H182 | sing | 1.09Å | 1.10Å | |
C19 | C20 | sing | 1.53Å | 1.55Å | |
C19 | H191 | sing | 1.09Å | 1.10Å | |
C19 | H192 | sing | 1.09Å | 1.10Å | |
C20 | H201 | sing | 1.09Å | 1.10Å | |
C20 | H202 | sing | 1.09Å | 1.10Å | |
N5 | C21 | sing | 1.47Å | 1.47Å | |
N5 | H5 | sing | 1.01Å | 1.00Å | |
C21 | C22 | sing | 1.51Å | 1.51Å | |
C21 | H211 | sing | 1.09Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
C22 | O2 | sing | 1.34Å | 1.22Å | |
C22 | O3 | doub | 1.21Å | 1.22Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C | N | H | 112.0° | 120.0° |
N | C | N1 | 120.4° | 120.0° |
N | C | C1 | 120.1° | 120.0° |
N1 | C | C1 | 119.5° | 120.0° |
C | N1 | H11A | 120.0° | 120.0° |
C | N1 | H12 | 120.0° | 120.0° |
C | C1 | N2 | 127.4° | 126.1° |
C | C1 | C3 | 125.7° | 126.1° |
H11A | N1 | H12 | 120.0° | 120.0° |
N2 | C1 | C3 | 106.9° | 107.8° |
C1 | N2 | C2 | 125.9° | 125.7° |
C1 | N2 | C5 | 108.4° | 108.5° |
C1 | C3 | C4 | 107.8° | 107.3° |
C1 | C3 | H3 | 126.1° | 126.3° |
C2 | N2 | C5 | 125.7° | 125.7° |
N2 | C2 | H21 | 109.5° | 109.5° |
N2 | C2 | H22 | 109.5° | 109.4° |
N2 | C2 | H23 | 109.4° | 109.5° |
N2 | C5 | C4 | 108.8° | 108.6° |
N2 | C5 | C6 | 126.2° | 125.7° |
H21 | C2 | H22 | 109.4° | 109.5° |
H21 | C2 | H23 | 109.5° | 109.5° |
H22 | C2 | H23 | 109.5° | 109.5° |
C4 | C3 | H3 | 126.1° | 126.4° |
C3 | C4 | C5 | 108.0° | 107.8° |
C3 | C4 | H4 | 126.0° | 126.2° |
C5 | C4 | H4 | 126.0° | 126.1° |
C4 | C5 | C6 | 125.0° | 125.7° |
C5 | C6 | N3 | 108.5° | 109.5° |
C5 | C6 | H61 | 109.8° | 109.5° |
C5 | C6 | H62 | 109.8° | 109.5° |
N3 | C6 | H61 | 109.8° | 109.4° |
N3 | C6 | H62 | 109.8° | 109.5° |
C6 | N3 | C7 | 122.1° | 120.0° |
C6 | N3 | HN3 | 119.0° | 120.0° |
H61 | C6 | H62 | 109.2° | 109.5° |
C7 | N3 | HN3 | 118.9° | 120.1° |
N3 | C7 | O | 121.2° | 120.0° |
N3 | C7 | C8 | 118.5° | 120.0° |
O | C7 | C8 | 120.3° | 120.0° |
C7 | C8 | C9 | 111.6° | 126.1° |
C7 | C8 | N4 | 110.8° | 126.2° |
C9 | C8 | N4 | 107.2° | 107.7° |
C8 | C9 | C10 | 110.2° | 107.4° |
C8 | C9 | H9 | 124.9° | 126.4° |
C8 | N4 | C11 | 104.4° | 108.4° |
C8 | N4 | C12 | 127.8° | 125.9° |
C10 | C9 | H9 | 124.9° | 126.2° |
C9 | C10 | C11 | 110.0° | 108.0° |
C9 | C10 | H10 | 125.0° | 126.1° |
C11 | C10 | H10 | 125.0° | 126.0° |
C10 | C11 | N4 | 107.4° | 108.6° |
C10 | C11 | H11 | 126.3° | 125.8° |
N4 | C11 | H11 | 126.3° | 125.7° |
C11 | N4 | C12 | 127.9° | 125.8° |
N4 | C12 | O1 | 120.1° | 120.0° |
N4 | C12 | C13 | 120.8° | 120.1° |
O1 | C12 | C13 | 119.1° | 120.0° |
C12 | C13 | C14 | 110.4° | 109.5° |
C12 | C13 | N5 | 109.5° | 109.5° |
C12 | C13 | H13 | 108.8° | 109.4° |
C14 | C13 | N5 | 109.3° | 109.5° |
C14 | C13 | H13 | 108.9° | 109.4° |
C13 | C14 | C15 | 111.0° | 109.5° |
C13 | C14 | H141 | 109.0° | 109.5° |
C13 | C14 | H142 | 109.0° | 109.4° |
N5 | C13 | H13 | 109.9° | 109.5° |
C13 | N5 | C21 | 120.5° | 111.0° |
C13 | N5 | H5 | 106.0° | 111.0° |
C15 | C14 | H141 | 109.0° | 109.5° |
C15 | C14 | H142 | 109.0° | 109.5° |
C14 | C15 | C16 | 109.6° | 109.5° |
C14 | C15 | C20 | 110.0° | 109.5° |
C14 | C15 | H15 | 109.1° | 109.5° |
H141 | C14 | H142 | 110.0° | 109.4° |
C16 | C15 | C20 | 109.7° | 109.5° |
C16 | C15 | H15 | 109.4° | 109.5° |
C15 | C16 | C17 | 110.2° | 109.5° |
C15 | C16 | H161 | 109.2° | 109.4° |
C15 | C16 | H162 | 109.2° | 109.4° |
C20 | C15 | H15 | 109.1° | 109.5° |
C15 | C20 | C19 | 110.0° | 109.5° |
C15 | C20 | H201 | 109.3° | 109.4° |
C15 | C20 | H202 | 109.3° | 109.5° |
C17 | C16 | H161 | 109.3° | 109.5° |
C17 | C16 | H162 | 109.3° | 109.6° |
C16 | C17 | C18 | 110.4° | 109.4° |
C16 | C17 | H171 | 109.2° | 109.5° |
C16 | C17 | H172 | 109.2° | 109.4° |
H161 | C16 | H162 | 109.7° | 109.5° |
C18 | C17 | H171 | 109.2° | 109.5° |
C18 | C17 | H172 | 109.2° | 109.5° |
C17 | C18 | C19 | 110.4° | 109.4° |
C17 | C18 | H181 | 109.1° | 109.4° |
C17 | C18 | H182 | 109.2° | 109.5° |
H171 | C17 | H172 | 109.8° | 109.5° |
C19 | C18 | H181 | 109.2° | 109.5° |
C19 | C18 | H182 | 109.2° | 109.5° |
C18 | C19 | C20 | 110.2° | 109.5° |
C18 | C19 | H191 | 109.2° | 109.5° |
C18 | C19 | H192 | 109.2° | 109.4° |
H181 | C18 | H182 | 109.8° | 109.5° |
C20 | C19 | H191 | 109.2° | 109.5° |
C20 | C19 | H192 | 109.2° | 109.5° |
C19 | C20 | H201 | 109.3° | 109.5° |
C19 | C20 | H202 | 109.3° | 109.5° |
H191 | C19 | H192 | 109.7° | 109.4° |
H201 | C20 | H202 | 109.7° | 109.4° |
C21 | N5 | H5 | 106.0° | 111.0° |
N5 | C21 | C22 | 109.9° | 109.5° |
N5 | C21 | H211 | 109.3° | 109.5° |
N5 | C21 | H212 | 109.3° | 109.4° |
C22 | C21 | H211 | 109.3° | 109.5° |
C22 | C21 | H212 | 109.3° | 109.5° |
C21 | C22 | O2 | 120.2° | 120.0° |
C21 | C22 | O3 | 119.9° | 120.0° |
H211 | C21 | H212 | 109.6° | 109.5° |
O2 | C22 | O3 | 119.8° | 120.0° |
C22 | O2 | HO2 | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N | C | N1 | C1 | 179.7° | 180.0° |
N | C | N1 | H11A | 179.7° | 12.9° |
N | C | N1 | H12 | 0.3° | 167.1° |
N | C | C1 | N2 | 44.4° | 174.4° |
N | C | C1 | C3 | 135.4° | 5.8° |
H | N | C | N1 | 179.7° | 180.0° |
H | N | C | C1 | 0.0° | 0.0° |
C | N1 | H11A | H12 | 180.0° | 180.0° |
N1 | C | C1 | N2 | 135.9° | 5.6° |
N1 | C | C1 | C3 | 44.3° | 174.2° |
C1 | C | N1 | H11A | 0.0° | 167.1° |
C1 | C | N1 | H12 | 180.0° | 12.9° |
C | C1 | N2 | C3 | 179.9° | 179.8° |
C | C1 | N2 | C2 | 0.3° | 0.1° |
C | C1 | N2 | C5 | 179.9° | 180.0° |
C | C1 | C3 | C4 | 179.8° | 180.0° |
C | C1 | C3 | H3 | 0.2° | 0.1° |
C1 | N2 | C2 | C5 | 179.8° | 179.9° |
C1 | N2 | C2 | H21 | 180.0° | 84.0° |
C1 | N2 | C2 | H22 | 60.0° | 156.0° |
C1 | N2 | C2 | H23 | 60.0° | 36.0° |
N2 | C1 | C3 | C4 | 0.0° | 0.2° |
N2 | C1 | C3 | H3 | 180.0° | 179.7° |
C1 | N2 | C5 | C4 | 0.1° | 0.1° |
C1 | N2 | C5 | C6 | 179.9° | 180.0° |
C3 | C1 | N2 | C2 | 179.9° | 179.7° |
C3 | C1 | N2 | C5 | 0.0° | 0.2° |
C1 | C3 | C4 | H3 | 180.0° | 179.9° |
C1 | C3 | C4 | C5 | 0.1° | 0.2° |
C1 | C3 | C4 | H4 | 179.9° | 179.9° |
N2 | C2 | H21 | H22 | 120.0° | 120.0° |
N2 | C2 | H21 | H23 | 120.0° | 120.0° |
N2 | C2 | H22 | H23 | 120.0° | 120.0° |
C2 | N2 | C5 | C4 | 179.9° | 179.8° |
C2 | N2 | C5 | C6 | 0.1° | 0.1° |
C5 | N2 | C2 | H21 | 0.2° | 95.9° |
C5 | N2 | C2 | H22 | 120.2° | 24.1° |
C5 | N2 | C2 | H23 | 119.8° | 144.1° |
N2 | C5 | C4 | C3 | 0.1° | 0.0° |
N2 | C5 | C4 | C6 | 180.0° | 179.9° |
N2 | C5 | C4 | H4 | 179.9° | 179.8° |
N2 | C5 | C6 | N3 | 81.5° | 85.0° |
N2 | C5 | C6 | H61 | 158.5° | 35.0° |
N2 | C5 | C6 | H62 | 38.5° | 155.0° |
H21 | C2 | H22 | H23 | 120.0° | 120.0° |
C3 | C4 | C5 | H4 | 180.0° | 179.8° |
C3 | C4 | C5 | C6 | 179.9° | 179.9° |
H3 | C3 | C4 | C5 | 179.9° | 179.8° |
H3 | C3 | C4 | H4 | 0.1° | 0.0° |
C4 | C5 | C6 | N3 | 98.5° | 95.1° |
C4 | C5 | C6 | H61 | 21.5° | 144.9° |
C4 | C5 | C6 | H62 | 141.5° | 24.9° |
H4 | C4 | C5 | C6 | 0.1° | 0.1° |
C5 | C6 | N3 | H61 | 120.0° | 120.0° |
C5 | C6 | N3 | H62 | 120.0° | 120.0° |
C5 | C6 | H61 | H62 | 120.4° | 120.0° |
C5 | C6 | N3 | C7 | 110.5° | 180.0° |
C5 | C6 | N3 | HN3 | 69.5° | 0.0° |
N3 | C6 | H61 | H62 | 120.4° | 120.0° |
C6 | N3 | C7 | HN3 | 180.0° | 180.0° |
C6 | N3 | C7 | O | 0.1° | 5.1° |
C6 | N3 | C7 | C8 | 179.4° | 175.0° |
H61 | C6 | N3 | C7 | 9.5° | 60.0° |
H61 | C6 | N3 | HN3 | 170.5° | 120.0° |
H62 | C6 | N3 | C7 | 129.5° | 60.0° |
H62 | C6 | N3 | HN3 | 50.5° | 120.0° |
N3 | C7 | O | C8 | 179.4° | 180.0° |
N3 | C7 | C8 | C9 | 127.2° | 6.2° |
N3 | C7 | C8 | N4 | 113.4° | 174.1° |
HN3 | N3 | C7 | O | 179.9° | 175.0° |
HN3 | N3 | C7 | C8 | 0.6° | 5.0° |
O | C7 | C8 | C9 | 53.4° | 173.8° |
O | C7 | C8 | N4 | 66.0° | 5.9° |
C7 | C8 | C9 | N4 | 121.5° | 179.7° |
C7 | C8 | C9 | C10 | 116.0° | 180.0° |
C7 | C8 | C9 | H9 | 64.0° | 0.0° |
C7 | C8 | N4 | C11 | 113.5° | 179.8° |
C7 | C8 | N4 | C12 | 66.6° | 0.0° |
C8 | C9 | C10 | H9 | 180.0° | 180.0° |
C8 | C9 | C10 | C11 | 0.1° | 0.0° |
C8 | C9 | C10 | H10 | 179.9° | 180.0° |
C9 | C8 | N4 | C11 | 8.5° | 0.5° |
C9 | C8 | N4 | C12 | 171.4° | 179.7° |
N4 | C8 | C9 | C10 | 5.5° | 0.3° |
N4 | C8 | C9 | H9 | 174.5° | 179.7° |
C8 | N4 | C11 | C10 | 8.6° | 0.5° |
C8 | N4 | C11 | C12 | 180.0° | 179.8° |
C8 | N4 | C11 | H11 | 171.4° | 179.8° |
C8 | N4 | C12 | O1 | 0.0° | 6.7° |
C8 | N4 | C12 | C13 | 180.0° | 173.3° |
C9 | C10 | C11 | H10 | 180.0° | 179.9° |
C9 | C10 | C11 | N4 | 5.7° | 0.3° |
C9 | C10 | C11 | H11 | 174.3° | 180.0° |
H9 | C9 | C10 | C11 | 179.8° | 180.0° |
H9 | C9 | C10 | H10 | 0.2° | 0.1° |
C10 | C11 | N4 | H11 | 180.0° | 179.7° |
C10 | C11 | N4 | C12 | 171.3° | 179.7° |
H10 | C10 | C11 | N4 | 174.3° | 179.7° |
H10 | C10 | C11 | H11 | 5.6° | 0.0° |
C11 | N4 | C12 | O1 | 179.9° | 173.1° |
C11 | N4 | C12 | C13 | 0.1° | 7.0° |
H11 | C11 | N4 | C12 | 8.6° | 0.0° |
N4 | C12 | O1 | C13 | 180.0° | 179.9° |
N4 | C12 | C13 | C14 | 108.3° | 77.8° |
N4 | C12 | C13 | N5 | 131.3° | 162.1° |
N4 | C12 | C13 | H13 | 11.2° | 42.1° |
O1 | C12 | C13 | C14 | 71.7° | 102.1° |
O1 | C12 | C13 | N5 | 48.7° | 17.9° |
O1 | C12 | C13 | H13 | 168.8° | 137.9° |
C12 | C13 | C14 | N5 | 120.5° | 120.0° |
C12 | C13 | C14 | H13 | 119.4° | 120.0° |
C12 | C13 | N5 | H13 | 119.4° | 120.0° |
C12 | C13 | C14 | C15 | 75.3° | 177.9° |
C12 | C13 | C14 | H141 | 44.7° | 62.1° |
C12 | C13 | C14 | H142 | 164.7° | 57.9° |
C12 | C13 | N5 | C21 | 92.9° | 69.0° |
C12 | C13 | N5 | H5 | 147.1° | 55.0° |
C14 | C13 | N5 | H13 | 119.5° | 120.0° |
C13 | C14 | C15 | H141 | 120.0° | 120.1° |
C13 | C14 | C15 | H142 | 120.0° | 120.0° |
C13 | C14 | H141 | H142 | 119.4° | 120.0° |
C13 | C14 | C15 | C16 | 154.1° | 62.6° |
C13 | C14 | C15 | C20 | 85.2° | 177.4° |
C13 | C14 | C15 | H15 | 34.4° | 57.4° |
C14 | C13 | N5 | C21 | 146.1° | 51.0° |
C14 | C13 | N5 | H5 | 26.1° | 175.0° |
N5 | C13 | C14 | C15 | 164.2° | 57.9° |
N5 | C13 | C14 | H141 | 75.8° | 177.9° |
N5 | C13 | C14 | H142 | 44.2° | 62.1° |
C13 | N5 | C21 | H5 | 120.0° | 124.0° |
C13 | N5 | C21 | C22 | 159.7° | 179.5° |
C13 | N5 | C21 | H211 | 80.3° | 60.4° |
C13 | N5 | C21 | H212 | 39.7° | 59.5° |
H13 | C13 | C14 | C15 | 44.1° | 62.1° |
H13 | C13 | C14 | H141 | 164.1° | 57.9° |
H13 | C13 | C14 | H142 | 75.9° | 177.9° |
H13 | C13 | N5 | C21 | 26.6° | 171.0° |
H13 | C13 | N5 | H5 | 93.5° | 65.0° |
C15 | C14 | H141 | H142 | 119.4° | 120.0° |
C14 | C15 | C16 | C20 | 120.8° | 120.0° |
C14 | C15 | C16 | H15 | 119.6° | 120.0° |
C14 | C15 | C20 | H15 | 119.6° | 120.0° |
C14 | C15 | C16 | C17 | 180.0° | 180.0° |
C14 | C15 | C16 | H161 | 60.0° | 60.0° |
C14 | C15 | C16 | H162 | 60.0° | 59.9° |
C14 | C15 | C20 | C19 | 179.9° | 180.0° |
C14 | C15 | C20 | H201 | 60.1° | 60.0° |
C14 | C15 | C20 | H202 | 59.9° | 60.0° |
H141 | C14 | C15 | C16 | 34.1° | 57.5° |
H141 | C14 | C15 | C20 | 154.8° | 62.5° |
H141 | C14 | C15 | H15 | 85.6° | 177.5° |
H142 | C14 | C15 | C16 | 85.9° | 177.4° |
H142 | C14 | C15 | C20 | 34.8° | 57.4° |
H142 | C14 | C15 | H15 | 154.4° | 62.6° |
C16 | C15 | C20 | H15 | 119.8° | 120.0° |
C15 | C16 | C17 | H161 | 120.0° | 119.9° |
C15 | C16 | C17 | H162 | 120.0° | 120.0° |
C15 | C16 | H161 | H162 | 119.7° | 119.9° |
C15 | C16 | C17 | C18 | 58.1° | 60.1° |
C15 | C16 | C17 | H171 | 61.9° | 60.0° |
C15 | C16 | C17 | H172 | 178.1° | 180.0° |
C16 | C15 | C20 | C19 | 59.5° | 60.0° |
C16 | C15 | C20 | H201 | 60.5° | 60.0° |
C16 | C15 | C20 | H202 | 179.4° | 180.0° |
C20 | C15 | C16 | C17 | 59.1° | 60.0° |
C20 | C15 | C16 | H161 | 179.2° | 180.0° |
C20 | C15 | C16 | H162 | 60.9° | 60.1° |
C15 | C20 | C19 | C18 | 58.7° | 60.0° |
C15 | C20 | C19 | H201 | 120.0° | 120.0° |
C15 | C20 | C19 | H202 | 120.0° | 120.0° |
C15 | C20 | C19 | H191 | 61.3° | 60.0° |
C15 | C20 | C19 | H192 | 178.7° | 180.0° |
C15 | C20 | H201 | H202 | 119.8° | 120.0° |
H15 | C15 | C16 | C17 | 60.4° | 60.0° |
H15 | C15 | C16 | H161 | 59.6° | 60.0° |
H15 | C15 | C16 | H162 | 179.5° | 179.9° |
H15 | C15 | C20 | C19 | 60.3° | 60.0° |
H15 | C15 | C20 | H201 | 179.7° | 180.0° |
H15 | C15 | C20 | H202 | 59.6° | 60.0° |
C17 | C16 | H161 | H162 | 119.8° | 120.1° |
C16 | C17 | C18 | H171 | 120.0° | 120.0° |
C16 | C17 | C18 | H172 | 120.0° | 119.9° |
C16 | C17 | H171 | H172 | 119.6° | 120.0° |
C16 | C17 | C18 | C19 | 57.1° | 60.1° |
C16 | C17 | C18 | H181 | 177.1° | 180.0° |
C16 | C17 | C18 | H182 | 62.9° | 60.0° |
H161 | C16 | C17 | C18 | 178.1° | 180.0° |
H161 | C16 | C17 | H171 | 58.1° | 59.9° |
H161 | C16 | C17 | H172 | 61.9° | 60.1° |
H162 | C16 | C17 | C18 | 61.9° | 59.9° |
H162 | C16 | C17 | H171 | 178.1° | 180.0° |
H162 | C16 | C17 | H172 | 58.1° | 60.0° |
C18 | C17 | H171 | H172 | 119.6° | 120.1° |
C17 | C18 | C19 | H181 | 120.0° | 119.9° |
C17 | C18 | C19 | H182 | 120.0° | 120.1° |
C17 | C18 | H181 | H182 | 119.6° | 120.0° |
C17 | C18 | C19 | C20 | 57.5° | 60.0° |
C17 | C18 | C19 | H191 | 62.5° | 60.0° |
C17 | C18 | C19 | H192 | 177.5° | 179.9° |
H171 | C17 | C18 | C19 | 62.9° | 60.0° |
H171 | C17 | C18 | H181 | 57.1° | 60.0° |
H171 | C17 | C18 | H182 | 177.1° | 180.0° |
H172 | C17 | C18 | C19 | 177.1° | 180.0° |
H172 | C17 | C18 | H181 | 62.9° | 60.1° |
H172 | C17 | C18 | H182 | 57.1° | 59.9° |
C19 | C18 | H181 | H182 | 119.6° | 120.0° |
C18 | C19 | C20 | H191 | 120.0° | 120.0° |
C18 | C19 | C20 | H192 | 120.0° | 120.0° |
C18 | C19 | H191 | H192 | 119.7° | 119.9° |
C18 | C19 | C20 | H201 | 61.3° | 60.0° |
C18 | C19 | C20 | H202 | 178.7° | 180.0° |
H181 | C18 | C19 | C20 | 177.5° | 179.9° |
H181 | C18 | C19 | H191 | 57.5° | 59.9° |
H181 | C18 | C19 | H192 | 62.6° | 60.0° |
H182 | C18 | C19 | C20 | 62.5° | 60.0° |
H182 | C18 | C19 | H191 | 177.5° | 180.0° |
H182 | C18 | C19 | H192 | 57.4° | 60.0° |
C20 | C19 | H191 | H192 | 119.7° | 120.0° |
C19 | C20 | H201 | H202 | 119.8° | 120.0° |
H191 | C19 | C20 | H201 | 178.7° | 180.0° |
H191 | C19 | C20 | H202 | 58.7° | 60.0° |
H192 | C19 | C20 | H201 | 58.7° | 60.0° |
H192 | C19 | C20 | H202 | 61.3° | 60.0° |
N5 | C21 | C22 | H211 | 120.0° | 120.0° |
N5 | C21 | C22 | H212 | 120.0° | 120.0° |
N5 | C21 | H211 | H212 | 119.8° | 120.0° |
N5 | C21 | C22 | O2 | 21.6° | 180.0° |
N5 | C21 | C22 | O3 | 158.5° | 0.0° |
H5 | N5 | C21 | C22 | 39.7° | 55.5° |
H5 | N5 | C21 | H211 | 159.7° | 175.6° |
H5 | N5 | C21 | H212 | 80.3° | 64.4° |
C22 | C21 | H211 | H212 | 119.8° | 120.0° |
C21 | C22 | O2 | O3 | 179.9° | 179.9° |
C21 | C22 | O2 | HO2 | 179.8° | 180.0° |
H211 | C21 | C22 | O2 | 141.6° | 60.0° |
H211 | C21 | C22 | O3 | 38.6° | 120.0° |
H212 | C21 | C22 | O2 | 98.4° | 60.1° |
H212 | C21 | C22 | O3 | 81.4° | 120.0° |
O3 | C22 | O2 | HO2 | 0.0° | 0.1° |