J15
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | O1 | sing | 1.43Å | 1.37Å | |
C1 | C2 | sing | 1.53Å | 1.52Å | |
C1 | O5 | sing | 1.43Å | 1.39Å | |
C1 | H1 | sing | 1.09Å | 1.11Å | |
O1 | C7 | sing | 1.36Å | 1.38Å | |
C7 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
C7 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
C8 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.10Å | |
C9 | N14 | sing | 1.48Å | 1.40Å | |
C9 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
N14 | O15 | sing | 1.22Å | 1.24Å | |
N14 | O16 | doub | 1.22Å | 1.23Å | |
C10 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
C10 | H10 | sing | 1.08Å | 1.10Å | |
C11 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
C11 | C13 | sing | 1.48Å | 1.42Å | |
C12 | H12 | sing | 1.08Å | 1.10Å | |
C13 | N18 | sing | 1.35Å | 1.35Å | |
C13 | O17 | doub | 1.22Å | 1.23Å | |
N18 | C19 | sing | 1.46Å | 1.46Å | |
N18 | H18 | sing | 0.97Å | 1.02Å | |
C19 | C20 | sing | 1.53Å | 1.53Å | |
C19 | H191 | sing | 1.09Å | 1.11Å | |
C19 | H192 | sing | 1.09Å | 1.12Å | |
C20 | C21 | sing | 1.53Å | 1.52Å | |
C20 | H201 | sing | 1.09Å | 1.12Å | |
C20 | H202 | sing | 1.09Å | 1.11Å | |
C21 | N22 | sing | 1.47Å | 1.27Å | |
C21 | H211 | sing | 1.09Å | 1.11Å | |
C21 | H212 | sing | 1.09Å | 1.11Å | |
N22 | C23 | sing | 1.47Å | 1.46Å | |
N22 | C27 | sing | 1.47Å | 1.46Å | |
C23 | C24 | sing | 1.53Å | 1.53Å | |
C23 | H231 | sing | 1.09Å | 1.11Å | |
C23 | H232 | sing | 1.09Å | 1.12Å | |
C24 | N25 | sing | 1.47Å | 1.46Å | |
C24 | H241 | sing | 1.09Å | 1.11Å | |
C24 | H242 | sing | 1.09Å | 1.12Å | |
N25 | C28 | sing | 1.47Å | 1.28Å | |
N25 | C26 | sing | 1.47Å | 1.47Å | |
C28 | C35 | sing | 1.53Å | 1.34Å | |
C28 | H281 | sing | 1.09Å | 1.11Å | |
C28 | H282 | sing | 1.09Å | 1.12Å | |
C35 | C36 | sing | 1.53Å | 1.52Å | |
C35 | H351 | sing | 1.09Å | 1.11Å | |
C35 | H352 | sing | 1.09Å | 1.12Å | |
C36 | N37 | sing | 1.47Å | 1.45Å | |
C36 | H361 | sing | 1.09Å | 1.11Å | |
C36 | H362 | sing | 1.09Å | 1.11Å | |
N37 | H371 | sing | 1.01Å | 1.02Å | |
N37 | H372 | sing | 1.01Å | 1.02Å | |
C26 | C27 | sing | 1.53Å | 1.53Å | |
C26 | H261 | sing | 1.09Å | 1.11Å | |
C26 | H262 | sing | 1.09Å | 1.12Å | |
C27 | H271 | sing | 1.09Å | 1.12Å | |
C27 | H272 | sing | 1.09Å | 1.11Å | |
C2 | O2 | sing | 1.43Å | 1.42Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
C2 | H2 | sing | 1.09Å | 1.12Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C3 | O3 | sing | 1.43Å | 1.42Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
C3 | H3 | sing | 1.09Å | 1.11Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C4 | O4 | sing | 1.43Å | 1.43Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C4 | H4 | sing | 1.09Å | 1.12Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C5 | O5 | sing | 1.43Å | 1.43Å | |
C5 | H5 | sing | 1.09Å | 1.11Å | |
C6 | O6 | sing | 1.43Å | 1.41Å | |
C6 | H61 | sing | 1.09Å | 1.12Å | |
C6 | H62 | sing | 1.09Å | 1.12Å | |
O6 | HO6 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C1 | C2 | 111.3° | 109.4° |
O1 | C1 | O5 | 119.4° | 109.5° |
O1 | C1 | H1 | 103.8° | 109.4° |
C1 | O1 | C7 | 119.9° | 106.8° |
C2 | C1 | O5 | 117.1° | 109.7° |
C2 | C1 | H1 | 107.0° | 109.4° |
C1 | C2 | O2 | 113.4° | 109.6° |
C1 | C2 | C3 | 106.2° | 109.0° |
C1 | C2 | H2 | 109.8° | 109.5° |
O5 | C1 | H1 | 95.0° | 109.4° |
C1 | O5 | C5 | 107.6° | 107.6° |
O1 | C7 | C8 | 117.6° | 120.0° |
O1 | C7 | C12 | 122.0° | 120.0° |
C8 | C7 | C12 | 120.4° | 120.0° |
C7 | C8 | C9 | 120.7° | 120.3° |
C7 | C8 | H8 | 119.6° | 119.9° |
C7 | C12 | C11 | 119.9° | 119.8° |
C7 | C12 | H12 | 119.6° | 120.1° |
C9 | C8 | H8 | 119.7° | 119.8° |
C8 | C9 | N14 | 120.3° | 119.9° |
C8 | C9 | C10 | 119.2° | 120.2° |
N14 | C9 | C10 | 120.5° | 119.9° |
C9 | N14 | O15 | 121.2° | 120.0° |
C9 | N14 | O16 | 117.1° | 120.0° |
C9 | C10 | C11 | 121.1° | 119.9° |
C9 | C10 | H10 | 118.7° | 120.0° |
O15 | N14 | O16 | 121.7° | 119.9° |
C11 | C10 | H10 | 120.1° | 120.1° |
C10 | C11 | C12 | 118.7° | 119.8° |
C10 | C11 | C13 | 122.8° | 120.1° |
C12 | C11 | C13 | 118.5° | 120.1° |
C11 | C12 | H12 | 120.5° | 120.2° |
C11 | C13 | N18 | 124.0° | 120.0° |
C11 | C13 | O17 | 117.6° | 120.0° |
N18 | C13 | O17 | 118.4° | 120.0° |
C13 | N18 | C19 | 125.3° | 120.0° |
C13 | N18 | H18 | 112.8° | 120.0° |
C19 | N18 | H18 | 121.9° | 120.0° |
N18 | C19 | C20 | 112.5° | 109.5° |
N18 | C19 | H191 | 111.1° | 109.5° |
N18 | C19 | H192 | 111.1° | 109.5° |
C20 | C19 | H191 | 111.2° | 109.5° |
C20 | C19 | H192 | 111.2° | 109.5° |
C19 | C20 | C21 | 110.0° | 109.5° |
C19 | C20 | H201 | 112.0° | 109.4° |
C19 | C20 | H202 | 112.0° | 109.5° |
H191 | C19 | H192 | 99.2° | 109.5° |
C21 | C20 | H201 | 112.0° | 109.5° |
C21 | C20 | H202 | 112.1° | 109.5° |
C20 | C21 | N22 | 116.1° | 109.5° |
C20 | C21 | H211 | 109.8° | 109.5° |
C20 | C21 | H212 | 109.8° | 109.5° |
H201 | C20 | H202 | 98.4° | 109.5° |
N22 | C21 | H211 | 109.8° | 109.4° |
N22 | C21 | H212 | 109.8° | 109.5° |
C21 | N22 | C23 | 111.8° | 106.7° |
C21 | N22 | C27 | 112.3° | 106.7° |
H211 | C21 | H212 | 100.4° | 109.5° |
C23 | N22 | C27 | 107.7° | 106.9° |
N22 | C23 | C24 | 111.2° | 109.6° |
N22 | C23 | H231 | 111.5° | 109.5° |
N22 | C23 | H232 | 111.5° | 109.4° |
N22 | C27 | C26 | 112.8° | 109.6° |
N22 | C27 | H271 | 110.9° | 109.5° |
N22 | C27 | H272 | 111.0° | 109.5° |
C24 | C23 | H231 | 111.6° | 109.5° |
C24 | C23 | H232 | 111.6° | 109.4° |
C23 | C24 | N25 | 115.4° | 109.7° |
C23 | C24 | H241 | 110.1° | 109.4° |
C23 | C24 | H242 | 110.0° | 109.4° |
H231 | C23 | H232 | 98.8° | 109.4° |
N25 | C24 | H241 | 110.1° | 109.5° |
N25 | C24 | H242 | 110.1° | 109.5° |
C24 | N25 | C28 | 111.4° | 106.7° |
C24 | N25 | C26 | 108.7° | 106.9° |
H241 | C24 | H242 | 100.2° | 109.4° |
C28 | N25 | C26 | 118.2° | 106.7° |
N25 | C28 | C35 | 118.5° | 109.5° |
N25 | C28 | H281 | 109.0° | 109.5° |
N25 | C28 | H282 | 109.0° | 109.5° |
N25 | C26 | C27 | 109.8° | 109.7° |
N25 | C26 | H261 | 112.1° | 109.5° |
N25 | C26 | H262 | 112.1° | 109.5° |
C35 | C28 | H281 | 108.9° | 109.5° |
C35 | C28 | H282 | 108.9° | 109.5° |
C28 | C35 | C36 | 114.1° | 109.5° |
C28 | C35 | H351 | 110.5° | 109.5° |
C28 | C35 | H352 | 110.5° | 109.5° |
H281 | C28 | H282 | 101.1° | 109.5° |
C36 | C35 | H351 | 110.6° | 109.5° |
C36 | C35 | H352 | 110.5° | 109.5° |
C35 | C36 | N37 | 110.8° | 109.5° |
C35 | C36 | H361 | 111.7° | 109.5° |
C35 | C36 | H362 | 111.7° | 109.5° |
H351 | C35 | H352 | 99.7° | 109.5° |
N37 | C36 | H361 | 111.7° | 109.4° |
N37 | C36 | H362 | 111.7° | 109.5° |
C36 | N37 | H371 | 110.9° | 106.6° |
C36 | N37 | H372 | 111.7° | 106.7° |
H361 | C36 | H362 | 98.7° | 109.5° |
H371 | N37 | H372 | 111.7° | 106.7° |
C27 | C26 | H261 | 112.1° | 109.4° |
C27 | C26 | H262 | 112.1° | 109.5° |
C26 | C27 | H271 | 111.0° | 109.5° |
C26 | C27 | H272 | 111.0° | 109.4° |
H261 | C26 | H262 | 98.3° | 109.4° |
H271 | C27 | H272 | 99.4° | 109.4° |
O2 | C2 | C3 | 111.6° | 109.6° |
O2 | C2 | H2 | 104.3° | 109.5° |
C2 | O2 | HO2 | 113.3° | 106.8° |
C3 | C2 | H2 | 111.6° | 109.6° |
C2 | C3 | O3 | 109.2° | 109.7° |
C2 | C3 | C4 | 110.0° | 108.6° |
C2 | C3 | H3 | 109.4° | 109.6° |
O3 | C3 | C4 | 109.7° | 109.6° |
O3 | C3 | H3 | 109.7° | 109.6° |
C3 | O3 | HO3 | 109.1° | 106.8° |
C4 | C3 | H3 | 108.9° | 109.6° |
C3 | C4 | O4 | 109.3° | 109.6° |
C3 | C4 | C5 | 110.5° | 109.0° |
C3 | C4 | H4 | 108.9° | 109.5° |
O4 | C4 | C5 | 109.6° | 109.5° |
O4 | C4 | H4 | 109.8° | 109.6° |
C4 | O4 | HO4 | 109.3° | 106.8° |
C5 | C4 | H4 | 108.7° | 109.6° |
C4 | C5 | C6 | 114.0° | 109.4° |
C4 | C5 | O5 | 111.7° | 109.8° |
C4 | C5 | H5 | 103.7° | 109.4° |
C6 | C5 | O5 | 106.1° | 109.5° |
C6 | C5 | H5 | 109.5° | 109.5° |
C5 | C6 | O6 | 108.6° | 109.5° |
C5 | C6 | H61 | 112.6° | 109.5° |
C5 | C6 | H62 | 112.5° | 109.4° |
O5 | C5 | H5 | 111.9° | 109.4° |
O6 | C6 | H61 | 112.5° | 109.5° |
O6 | C6 | H62 | 112.6° | 109.5° |
C6 | O6 | HO6 | 108.5° | 106.8° |
H61 | C6 | H62 | 97.8° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C1 | C2 | O5 | 142.3° | 120.1° |
O1 | C1 | C2 | H1 | 112.7° | 119.9° |
O1 | C1 | O5 | H1 | 108.8° | 119.9° |
C1 | O1 | C7 | C8 | 80.8° | 174.4° |
C1 | O1 | C7 | C12 | 101.4° | 5.6° |
O1 | C1 | C2 | O2 | 40.0° | 61.1° |
O1 | C1 | C2 | C3 | 83.0° | 58.8° |
O1 | C1 | C2 | H2 | 156.1° | 178.7° |
O1 | C1 | O5 | C5 | 75.6° | 52.5° |
C2 | C1 | O5 | H1 | 112.0° | 120.0° |
C2 | C1 | O1 | C7 | 169.9° | 165.6° |
C1 | C2 | O2 | C3 | 119.9° | 119.6° |
C1 | C2 | O2 | H2 | 119.4° | 120.2° |
C1 | C2 | C3 | H2 | 119.7° | 119.9° |
C1 | C2 | O2 | HO2 | 180.0° | 60.3° |
C1 | C2 | C3 | O3 | 171.2° | 173.6° |
C1 | C2 | C3 | C4 | 50.7° | 53.8° |
C1 | C2 | C3 | H3 | 68.8° | 66.0° |
C2 | C1 | O5 | C5 | 63.5° | 67.6° |
O5 | C1 | O1 | C7 | 48.8° | 74.1° |
O5 | C1 | C2 | O2 | 177.7° | 178.7° |
O5 | C1 | C2 | C3 | 59.3° | 61.3° |
O5 | C1 | C2 | H2 | 61.6° | 58.6° |
C1 | O5 | C5 | C4 | 59.7° | 67.6° |
C1 | O5 | C5 | C6 | 175.5° | 172.4° |
C1 | O5 | C5 | H5 | 56.0° | 52.4° |
H1 | C1 | O1 | C7 | 55.1° | 45.8° |
H1 | C1 | C2 | O2 | 72.8° | 58.7° |
H1 | C1 | C2 | C3 | 164.3° | 178.7° |
H1 | C1 | C2 | H2 | 43.4° | 61.5° |
H1 | C1 | O5 | C5 | 175.6° | 172.4° |
O1 | C7 | C8 | C12 | 177.8° | 180.0° |
O1 | C7 | C8 | C9 | 178.1° | 180.0° |
O1 | C7 | C8 | H8 | 2.0° | 0.1° |
O1 | C7 | C12 | C11 | 178.4° | 180.0° |
O1 | C7 | C12 | H12 | 1.7° | 0.0° |
C7 | C8 | C9 | H8 | 180.0° | 179.9° |
C7 | C8 | C9 | N14 | 178.3° | 179.9° |
C7 | C8 | C9 | C10 | 0.6° | 0.4° |
C8 | C7 | C12 | C11 | 0.6° | 0.0° |
C8 | C7 | C12 | H12 | 179.4° | 180.0° |
C12 | C7 | C8 | C9 | 0.2° | 0.1° |
C12 | C7 | C8 | H8 | 179.8° | 180.0° |
C7 | C12 | C11 | C10 | 0.2° | 0.2° |
C7 | C12 | C11 | H12 | 180.0° | 180.0° |
C7 | C12 | C11 | C13 | 179.3° | 180.0° |
C8 | C9 | N14 | C10 | 177.7° | 179.7° |
C8 | C9 | N14 | O15 | 1.0° | 0.1° |
C8 | C9 | N14 | O16 | 178.4° | 179.9° |
C8 | C9 | C10 | C11 | 1.0° | 0.6° |
C8 | C9 | C10 | H10 | 178.9° | 180.0° |
H8 | C8 | C9 | N14 | 1.7° | 0.1° |
H8 | C8 | C9 | C10 | 179.4° | 179.8° |
C9 | N14 | O15 | O16 | 177.3° | 180.0° |
N14 | C9 | C10 | C11 | 178.7° | 179.7° |
N14 | C9 | C10 | H10 | 1.3° | 0.3° |
C10 | C9 | N14 | O15 | 176.7° | 179.8° |
C10 | C9 | N14 | O16 | 0.7° | 0.2° |
C9 | C10 | C11 | H10 | 179.9° | 179.5° |
C9 | C10 | C11 | C12 | 0.6° | 0.5° |
C9 | C10 | C11 | C13 | 179.8° | 179.7° |
C10 | C11 | C12 | C13 | 179.6° | 179.8° |
C10 | C11 | C12 | H12 | 179.8° | 179.8° |
C10 | C11 | C13 | N18 | 1.9° | 0.2° |
C10 | C11 | C13 | O17 | 179.3° | 179.7° |
H10 | C10 | C11 | C12 | 179.4° | 180.0° |
H10 | C10 | C11 | C13 | 0.2° | 0.3° |
C12 | C11 | C13 | N18 | 178.5° | 180.0° |
C12 | C11 | C13 | O17 | 1.1° | 0.1° |
C13 | C11 | C12 | H12 | 0.6° | 0.0° |
C11 | C13 | N18 | O17 | 177.4° | 179.9° |
C11 | C13 | N18 | C19 | 5.9° | 180.0° |
C11 | C13 | N18 | H18 | 174.0° | 0.0° |
C13 | N18 | C19 | H18 | 180.0° | 180.0° |
C13 | N18 | C19 | C20 | 149.0° | 180.0° |
C13 | N18 | C19 | H191 | 23.7° | 60.0° |
C13 | N18 | C19 | H192 | 85.7° | 60.0° |
O17 | C13 | N18 | C19 | 171.4° | 0.0° |
O17 | C13 | N18 | H18 | 8.6° | 180.0° |
N18 | C19 | C20 | H191 | 125.3° | 120.0° |
N18 | C19 | C20 | H192 | 125.2° | 120.0° |
N18 | C19 | H191 | H192 | 116.9° | 120.0° |
N18 | C19 | C20 | C21 | 96.8° | 180.0° |
N18 | C19 | C20 | H201 | 137.9° | 60.0° |
N18 | C19 | C20 | H202 | 28.5° | 60.0° |
H18 | N18 | C19 | C20 | 31.0° | 0.0° |
H18 | N18 | C19 | H191 | 156.3° | 120.0° |
H18 | N18 | C19 | H192 | 94.3° | 120.0° |
C20 | C19 | H191 | H192 | 117.1° | 120.0° |
C19 | C20 | C21 | H201 | 125.2° | 119.9° |
C19 | C20 | C21 | H202 | 125.2° | 120.0° |
C19 | C20 | H201 | H202 | 117.9° | 120.0° |
C19 | C20 | C21 | N22 | 81.4° | 180.0° |
C19 | C20 | C21 | H211 | 153.4° | 60.0° |
C19 | C20 | C21 | H212 | 43.9° | 60.0° |
H191 | C19 | C20 | C21 | 28.4° | 60.0° |
H191 | C19 | C20 | H201 | 96.8° | 180.0° |
H191 | C19 | C20 | H202 | 153.7° | 60.0° |
H192 | C19 | C20 | C21 | 137.9° | 60.0° |
H192 | C19 | C20 | H201 | 12.7° | 60.0° |
H192 | C19 | C20 | H202 | 96.8° | 180.0° |
C21 | C20 | H201 | H202 | 118.0° | 120.1° |
C20 | C21 | N22 | H211 | 125.3° | 120.0° |
C20 | C21 | N22 | H212 | 125.2° | 120.0° |
C20 | C21 | H211 | H212 | 115.6° | 120.0° |
C20 | C21 | N22 | C23 | 150.7° | 170.0° |
C20 | C21 | N22 | C27 | 88.0° | 76.0° |
H201 | C20 | C21 | N22 | 43.9° | 60.1° |
H201 | C20 | C21 | H211 | 81.4° | 180.0° |
H201 | C20 | C21 | H212 | 169.1° | 60.0° |
H202 | C20 | C21 | N22 | 153.4° | 60.0° |
H202 | C20 | C21 | H211 | 28.1° | 60.0° |
H202 | C20 | C21 | H212 | 81.4° | 180.0° |
N22 | C21 | H211 | H212 | 115.6° | 120.0° |
C21 | N22 | C23 | C27 | 123.9° | 113.8° |
C21 | N22 | C23 | C24 | 177.9° | 175.0° |
C21 | N22 | C23 | H231 | 52.6° | 64.9° |
C21 | N22 | C23 | H232 | 56.8° | 55.0° |
C21 | N22 | C27 | C26 | 176.7° | 175.1° |
C21 | N22 | C27 | H271 | 51.5° | 64.8° |
C21 | N22 | C27 | H272 | 58.0° | 55.1° |
H211 | C21 | N22 | C23 | 84.1° | 50.0° |
H211 | C21 | N22 | C27 | 37.2° | 164.0° |
H212 | C21 | N22 | C23 | 25.4° | 70.0° |
H212 | C21 | N22 | C27 | 146.7° | 44.0° |
N22 | C23 | C24 | H231 | 125.3° | 120.1° |
N22 | C23 | C24 | H232 | 125.2° | 120.0° |
N22 | C23 | H231 | H232 | 117.4° | 119.9° |
N22 | C23 | C24 | N25 | 54.0° | 63.0° |
N22 | C23 | C24 | H241 | 179.3° | 57.2° |
N22 | C23 | C24 | H242 | 71.3° | 177.0° |
C23 | N22 | C27 | C26 | 59.7° | 61.2° |
C23 | N22 | C27 | H271 | 175.1° | 178.7° |
C23 | N22 | C27 | H272 | 65.5° | 58.8° |
C27 | N22 | C23 | C24 | 54.0° | 61.2° |
C27 | N22 | C23 | H231 | 71.3° | 178.7° |
C27 | N22 | C23 | H232 | 179.3° | 58.8° |
N22 | C27 | C26 | N25 | 61.3° | 62.9° |
N22 | C27 | C26 | H271 | 125.2° | 120.1° |
N22 | C27 | C26 | H272 | 125.3° | 120.0° |
N22 | C27 | C26 | H261 | 173.4° | 177.0° |
N22 | C27 | C26 | H262 | 64.0° | 57.2° |
N22 | C27 | H271 | H272 | 116.9° | 120.0° |
C24 | C23 | H231 | H232 | 117.5° | 119.9° |
C23 | C24 | N25 | H241 | 125.3° | 120.0° |
C23 | C24 | N25 | H242 | 125.2° | 120.0° |
C23 | C24 | H241 | H242 | 115.9° | 119.8° |
C23 | C24 | N25 | C28 | 175.0° | 175.1° |
C23 | C24 | N25 | C26 | 53.1° | 61.2° |
H231 | C23 | C24 | N25 | 71.3° | 177.0° |
H231 | C23 | C24 | H241 | 54.0° | 62.9° |
H231 | C23 | C24 | H242 | 163.5° | 56.9° |
H232 | C23 | C24 | N25 | 179.2° | 57.1° |
H232 | C23 | C24 | H241 | 55.5° | 177.2° |
H232 | C23 | C24 | H242 | 54.0° | 63.0° |
N25 | C24 | H241 | H242 | 115.9° | 120.0° |
C24 | N25 | C28 | C26 | 126.9° | 114.0° |
C24 | N25 | C28 | C35 | 138.8° | 170.0° |
C24 | N25 | C28 | H281 | 95.9° | 50.0° |
C24 | N25 | C28 | H282 | 13.6° | 70.0° |
C24 | N25 | C26 | C27 | 54.5° | 61.2° |
C24 | N25 | C26 | H261 | 179.8° | 178.7° |
C24 | N25 | C26 | H262 | 70.7° | 58.8° |
H241 | C24 | N25 | C28 | 49.7° | 55.1° |
H241 | C24 | N25 | C26 | 178.3° | 58.8° |
H242 | C24 | N25 | C28 | 59.8° | 64.9° |
H242 | C24 | N25 | C26 | 72.2° | 178.7° |
N25 | C28 | C35 | H281 | 125.3° | 120.0° |
N25 | C28 | C35 | H282 | 125.3° | 120.0° |
N25 | C28 | H281 | H282 | 114.7° | 120.0° |
N25 | C28 | C35 | C36 | 85.4° | 180.0° |
N25 | C28 | C35 | H351 | 149.3° | 60.0° |
N25 | C28 | C35 | H352 | 39.9° | 60.0° |
C28 | N25 | C26 | C27 | 177.3° | 175.1° |
C28 | N25 | C26 | H261 | 52.0° | 64.9° |
C28 | N25 | C26 | H262 | 57.5° | 55.0° |
C26 | N25 | C28 | C35 | 11.9° | 56.0° |
C26 | N25 | C28 | H281 | 137.2° | 64.0° |
C26 | N25 | C28 | H282 | 113.3° | 176.0° |
N25 | C26 | C27 | H261 | 125.3° | 120.1° |
N25 | C26 | C27 | H262 | 125.2° | 120.1° |
N25 | C26 | H261 | H262 | 118.0° | 119.9° |
N25 | C26 | C27 | H271 | 173.5° | 177.0° |
N25 | C26 | C27 | H272 | 64.0° | 57.1° |
C35 | C28 | H281 | H282 | 114.7° | 120.0° |
C28 | C35 | C36 | H351 | 125.3° | 120.0° |
C28 | C35 | C36 | H352 | 125.3° | 120.0° |
C28 | C35 | H351 | H352 | 116.4° | 120.0° |
C28 | C35 | C36 | N37 | 167.2° | 180.0° |
C28 | C35 | C36 | H361 | 41.9° | 60.0° |
C28 | C35 | C36 | H362 | 67.6° | 60.0° |
H281 | C28 | C35 | C36 | 39.9° | 60.0° |
H281 | C28 | C35 | H351 | 85.4° | 180.0° |
H281 | C28 | C35 | H352 | 165.1° | 60.0° |
H282 | C28 | C35 | C36 | 149.4° | 60.0° |
H282 | C28 | C35 | H351 | 24.0° | 60.0° |
H282 | C28 | C35 | H352 | 85.4° | 180.0° |
C36 | C35 | H351 | H352 | 116.4° | 120.0° |
C35 | C36 | N37 | H361 | 125.2° | 120.0° |
C35 | C36 | N37 | H362 | 125.2° | 120.1° |
C35 | C36 | H361 | H362 | 117.6° | 120.0° |
C35 | C36 | N37 | H371 | 180.0° | 66.2° |
C35 | C36 | N37 | H372 | 54.7° | 180.0° |
H351 | C35 | C36 | N37 | 67.5° | 60.0° |
H351 | C35 | C36 | H361 | 167.2° | 180.0° |
H351 | C35 | C36 | H362 | 57.7° | 60.0° |
H352 | C35 | C36 | N37 | 41.9° | 60.0° |
H352 | C35 | C36 | H361 | 83.3° | 60.0° |
H352 | C35 | C36 | H362 | 167.2° | 180.0° |
N37 | C36 | H361 | H362 | 117.7° | 120.0° |
C36 | N37 | H371 | H372 | 125.3° | 113.8° |
H361 | C36 | N37 | H371 | 54.8° | 173.8° |
H361 | C36 | N37 | H372 | 70.5° | 60.0° |
H362 | C36 | N37 | H371 | 54.8° | 53.8° |
H362 | C36 | N37 | H372 | 179.9° | 59.9° |
C27 | C26 | H261 | H262 | 118.0° | 119.9° |
C26 | C27 | H271 | H272 | 116.8° | 119.8° |
H261 | C26 | C27 | H271 | 48.2° | 56.9° |
H261 | C26 | C27 | H272 | 61.3° | 63.0° |
H262 | C26 | C27 | H271 | 61.2° | 62.9° |
H262 | C26 | C27 | H272 | 170.8° | 177.2° |
O2 | C2 | C3 | H2 | 116.2° | 120.2° |
O2 | C2 | C3 | O3 | 64.8° | 66.5° |
O2 | C2 | C3 | C4 | 174.8° | 173.7° |
O2 | C2 | C3 | H3 | 55.2° | 53.9° |
C3 | C2 | O2 | HO2 | 60.1° | 179.9° |
C2 | C3 | O3 | C4 | 120.6° | 119.2° |
C2 | C3 | O3 | H3 | 119.8° | 120.5° |
C2 | C3 | C4 | H3 | 119.8° | 119.8° |
C2 | C3 | O3 | HO3 | 180.0° | 60.8° |
C2 | C3 | C4 | O4 | 67.7° | 66.1° |
C2 | C3 | C4 | C5 | 52.9° | 53.8° |
C2 | C3 | C4 | H4 | 172.3° | 173.6° |
H2 | C2 | O2 | HO2 | 60.5° | 59.9° |
H2 | C2 | C3 | O3 | 51.4° | 53.7° |
H2 | C2 | C3 | C4 | 69.0° | 66.1° |
H2 | C2 | C3 | H3 | 171.5° | 174.1° |
O3 | C3 | C4 | H3 | 120.0° | 120.3° |
O3 | C3 | C4 | O4 | 52.4° | 53.7° |
O3 | C3 | C4 | C5 | 173.1° | 173.6° |
O3 | C3 | C4 | H4 | 67.6° | 66.5° |
C4 | C3 | O3 | HO3 | 59.3° | 180.0° |
C3 | C4 | O4 | C5 | 121.2° | 119.6° |
C3 | C4 | O4 | H4 | 119.4° | 120.2° |
C3 | C4 | C5 | H4 | 119.5° | 119.8° |
C3 | C4 | O4 | HO4 | 180.0° | 60.4° |
C3 | C4 | C5 | C6 | 177.7° | 178.7° |
C3 | C4 | C5 | O5 | 57.5° | 61.2° |
C3 | C4 | C5 | H5 | 63.3° | 58.8° |
H3 | C3 | O3 | HO3 | 60.2° | 59.7° |
H3 | C3 | C4 | O4 | 172.4° | 174.1° |
H3 | C3 | C4 | C5 | 66.9° | 66.0° |
H3 | C3 | C4 | H4 | 52.4° | 53.8° |
O4 | C4 | C5 | H4 | 120.0° | 120.2° |
O4 | C4 | C5 | C6 | 57.2° | 61.4° |
O4 | C4 | C5 | O5 | 63.0° | 58.7° |
O4 | C4 | C5 | H5 | 176.2° | 178.8° |
C5 | C4 | O4 | HO4 | 58.8° | 180.0° |
C4 | C5 | C6 | O5 | 123.4° | 120.3° |
C4 | C5 | C6 | H5 | 115.6° | 119.8° |
C4 | C5 | O5 | H5 | 115.8° | 120.0° |
C4 | C5 | C6 | O6 | 174.3° | 174.7° |
C4 | C5 | C6 | H61 | 49.0° | 54.7° |
C4 | C5 | C6 | H62 | 60.4° | 65.3° |
H4 | C4 | O4 | HO4 | 60.5° | 59.8° |
H4 | C4 | C5 | C6 | 62.8° | 58.8° |
H4 | C4 | C5 | O5 | 177.0° | 178.9° |
H4 | C4 | C5 | H5 | 56.2° | 61.0° |
C6 | C5 | O5 | H5 | 119.4° | 119.9° |
C5 | C6 | O6 | H61 | 125.3° | 120.0° |
C5 | C6 | O6 | H62 | 125.3° | 120.0° |
C5 | C6 | H61 | H62 | 118.4° | 120.0° |
C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
O5 | C5 | C6 | O6 | 62.3° | 65.0° |
O5 | C5 | C6 | H61 | 172.4° | 175.0° |
O5 | C5 | C6 | H62 | 63.0° | 55.0° |
H5 | C5 | C6 | O6 | 58.7° | 54.9° |
H5 | C5 | C6 | H61 | 66.6° | 65.1° |
H5 | C5 | C6 | H62 | 176.0° | 174.9° |
O6 | C6 | H61 | H62 | 118.5° | 120.0° |
H61 | C6 | O6 | HO6 | 54.7° | 60.0° |
H62 | C6 | O6 | HO6 | 54.7° | 60.0° |