15B
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | O1 | sing | 1.43Å | 1.39Å | |
C1 | C2 | sing | 1.53Å | 1.52Å | |
C1 | O5 | sing | 1.43Å | 1.41Å | |
C1 | H1 | sing | 1.10Å | 1.10Å | |
O1 | C7 | sing | 1.37Å | 1.45Å | |
C7 | C8 | doub | 1.39Å | 1.38Å | Aromatic |
C7 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
C8 | C9 | sing | 1.39Å | 1.38Å | Aromatic |
C8 | H8 | sing | 1.09Å | 1.08Å | |
C9 | N14 | sing | 1.42Å | 1.33Å | |
C9 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
N14 | O15 | sing | 1.25Å | 1.23Å | |
N14 | O16 | doub | 1.25Å | 1.22Å | |
C10 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
C10 | H10 | sing | 1.09Å | 1.08Å | |
C11 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
C11 | C13 | sing | 1.45Å | 1.40Å | |
C12 | H12 | sing | 1.09Å | 1.08Å | |
C13 | N18 | sing | 1.40Å | 1.27Å | |
C13 | O17 | doub | 1.24Å | 1.21Å | |
N18 | C19 | sing | 1.45Å | 1.47Å | |
N18 | H18 | sing | 1.01Å | 1.00Å | |
C19 | C20 | sing | 1.53Å | 1.53Å | |
C19 | H191 | sing | 1.10Å | 1.10Å | |
C19 | H192 | sing | 1.09Å | 1.10Å | |
C20 | C21 | sing | 1.53Å | 1.52Å | |
C20 | H201 | sing | 1.10Å | 1.10Å | |
C20 | H202 | sing | 1.10Å | 1.10Å | |
C21 | N22 | sing | 1.46Å | 1.28Å | |
C21 | H211 | sing | 1.09Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
N22 | C23 | sing | 1.47Å | 1.46Å | |
N22 | C27 | sing | 1.47Å | 1.47Å | |
C23 | C24 | sing | 1.53Å | 1.52Å | |
C23 | H231 | sing | 1.10Å | 1.10Å | |
C23 | H232 | sing | 1.10Å | 1.10Å | |
C24 | N25 | sing | 1.47Å | 1.45Å | |
C24 | H241 | sing | 1.10Å | 1.10Å | |
C24 | H242 | sing | 1.10Å | 1.10Å | |
N25 | C28 | sing | 1.46Å | 1.22Å | |
N25 | C26 | sing | 1.47Å | 1.45Å | |
C28 | C35 | sing | 1.53Å | 1.26Å | |
C28 | H281 | sing | 1.09Å | 1.10Å | |
C28 | H282 | sing | 1.09Å | 1.10Å | |
C35 | C36 | sing | 1.53Å | 1.52Å | |
C35 | H351 | sing | 1.10Å | 1.10Å | |
C35 | H352 | sing | 1.10Å | 1.10Å | |
C36 | N37 | sing | 1.44Å | 1.45Å | |
C36 | H361 | sing | 1.09Å | 1.10Å | |
C36 | H362 | sing | 1.09Å | 1.10Å | |
N37 | H371 | sing | 1.01Å | 1.00Å | |
N37 | H372 | sing | 1.01Å | 1.00Å | |
C26 | C27 | sing | 1.53Å | 1.53Å | |
C26 | H261 | sing | 1.10Å | 1.10Å | |
C26 | H262 | sing | 1.10Å | 1.10Å | |
C27 | H271 | sing | 1.10Å | 1.10Å | |
C27 | H272 | sing | 1.10Å | 1.10Å | |
C2 | O2 | sing | 1.43Å | 1.42Å | |
C2 | C3 | sing | 1.53Å | 1.54Å | |
C2 | H2 | sing | 1.10Å | 1.10Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C3 | O3 | sing | 1.43Å | 1.42Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
C3 | H3 | sing | 1.10Å | 1.10Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C4 | O4 | sing | 1.43Å | 1.43Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C4 | H4 | sing | 1.10Å | 1.10Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C5 | C6 | sing | 1.52Å | 1.52Å | |
C5 | O5 | sing | 1.43Å | 1.44Å | |
C5 | H5 | sing | 1.10Å | 1.10Å | |
C6 | O6 | sing | 1.42Å | 1.43Å | |
C6 | H61 | sing | 1.09Å | 1.10Å | |
C6 | H62 | sing | 1.09Å | 1.10Å | |
O6 | HO6 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C1 | C2 | 109.3° | 110.1° |
O1 | C1 | O5 | 104.4° | 109.8° |
O1 | C1 | H1 | 113.0° | 106.0° |
C1 | O1 | C7 | 115.1° | 116.6° |
C2 | C1 | O5 | 109.8° | 111.0° |
C2 | C1 | H1 | 107.8° | 110.9° |
C1 | C2 | O2 | 109.0° | 108.4° |
C1 | C2 | C3 | 109.2° | 110.8° |
C1 | C2 | H2 | 110.7° | 110.8° |
O5 | C1 | H1 | 112.5° | 109.0° |
C1 | O5 | C5 | 109.6° | 113.1° |
O1 | C7 | C8 | 116.1° | 119.8° |
O1 | C7 | C12 | 122.5° | 119.8° |
C8 | C7 | C12 | 121.3° | 120.5° |
C7 | C8 | C9 | 119.4° | 119.7° |
C7 | C8 | H8 | 120.3° | 119.8° |
C7 | C12 | C11 | 118.9° | 119.8° |
C7 | C12 | H12 | 120.6° | 120.0° |
C9 | C8 | H8 | 120.3° | 120.4° |
C8 | C9 | N14 | 119.0° | 120.0° |
C8 | C9 | C10 | 120.7° | 120.0° |
N14 | C9 | C10 | 120.4° | 120.0° |
C9 | N14 | O15 | 120.9° | 118.9° |
C9 | N14 | O16 | 118.4° | 119.0° |
C9 | C10 | C11 | 120.1° | 120.0° |
C9 | C10 | H10 | 119.9° | 120.1° |
O15 | N14 | O16 | 120.7° | 122.1° |
C11 | C10 | H10 | 120.0° | 119.8° |
C10 | C11 | C12 | 119.7° | 119.9° |
C10 | C11 | C13 | 120.2° | 120.1° |
C12 | C11 | C13 | 120.1° | 120.0° |
C11 | C12 | H12 | 120.5° | 120.2° |
C11 | C13 | N18 | 118.8° | 117.0° |
C11 | C13 | O17 | 119.8° | 120.5° |
N18 | C13 | O17 | 121.4° | 122.5° |
C13 | N18 | C19 | 127.1° | 123.5° |
C13 | N18 | H18 | 116.5° | 119.2° |
C19 | N18 | H18 | 116.5° | 117.1° |
N18 | C19 | C20 | 110.0° | 112.6° |
N18 | C19 | H191 | 109.3° | 106.9° |
N18 | C19 | H192 | 109.2° | 107.8° |
C20 | C19 | H191 | 109.3° | 109.9° |
C20 | C19 | H192 | 109.2° | 111.5° |
C19 | C20 | C21 | 110.6° | 113.8° |
C19 | C20 | H201 | 109.1° | 109.3° |
C19 | C20 | H202 | 108.9° | 108.6° |
H191 | C19 | H192 | 109.9° | 108.0° |
C21 | C20 | H201 | 109.1° | 108.6° |
C21 | C20 | H202 | 108.8° | 109.3° |
C20 | C21 | N22 | 119.1° | 112.5° |
C20 | C21 | H211 | 106.4° | 111.5° |
C20 | C21 | H212 | 104.2° | 109.9° |
H201 | C20 | H202 | 110.3° | 107.0° |
N22 | C21 | H211 | 106.4° | 107.8° |
N22 | C21 | H212 | 104.1° | 106.9° |
C21 | N22 | C23 | 110.5° | 110.8° |
C21 | N22 | C27 | 107.2° | 110.8° |
H211 | C21 | H212 | 117.4° | 108.0° |
C23 | N22 | C27 | 113.0° | 110.4° |
N22 | C23 | C24 | 113.4° | 110.9° |
N22 | C23 | H231 | 108.2° | 110.7° |
N22 | C23 | H232 | 107.3° | 109.6° |
N22 | C27 | C26 | 120.4° | 110.8° |
N22 | C27 | H271 | 106.0° | 109.6° |
N22 | C27 | H272 | 103.4° | 110.7° |
C24 | C23 | H231 | 108.2° | 109.8° |
C24 | C23 | H232 | 107.3° | 108.6° |
C23 | C24 | N25 | 111.9° | 110.9° |
C23 | C24 | H241 | 108.7° | 109.7° |
C23 | C24 | H242 | 108.1° | 108.5° |
H231 | C23 | H232 | 112.6° | 107.3° |
N25 | C24 | H241 | 108.7° | 110.8° |
N25 | C24 | H242 | 108.1° | 109.6° |
C24 | N25 | C28 | 112.3° | 110.8° |
C24 | N25 | C26 | 107.6° | 110.4° |
H241 | C24 | H242 | 111.4° | 107.2° |
C28 | N25 | C26 | 112.3° | 110.8° |
N25 | C28 | C35 | 112.8° | 112.6° |
N25 | C28 | H281 | 108.4° | 107.8° |
N25 | C28 | H282 | 107.6° | 106.8° |
N25 | C26 | C27 | 112.1° | 110.8° |
N25 | C26 | H261 | 108.6° | 109.6° |
N25 | C26 | H262 | 108.0° | 110.8° |
C35 | C28 | H281 | 108.4° | 111.5° |
C35 | C28 | H282 | 107.6° | 109.9° |
C28 | C35 | C36 | 115.4° | 113.8° |
C28 | C35 | H351 | 107.5° | 108.6° |
C28 | C35 | H352 | 106.2° | 109.3° |
H281 | C28 | H282 | 112.1° | 108.0° |
C36 | C35 | H351 | 107.5° | 109.3° |
C36 | C35 | H352 | 106.1° | 108.6° |
C35 | C36 | N37 | 111.6° | 112.6° |
C35 | C36 | H361 | 108.8° | 109.9° |
C35 | C36 | H362 | 108.3° | 111.5° |
H351 | C35 | H352 | 114.3° | 107.1° |
N37 | C36 | H361 | 108.8° | 106.9° |
N37 | C36 | H362 | 108.3° | 107.8° |
C36 | N37 | H371 | 109.5° | 119.2° |
C36 | N37 | H372 | 109.5° | 119.3° |
H361 | C36 | H362 | 111.1° | 108.0° |
H371 | N37 | H372 | 109.5° | 120.1° |
C27 | C26 | H261 | 108.6° | 108.5° |
C27 | C26 | H262 | 108.1° | 109.7° |
C26 | C27 | H271 | 106.0° | 108.5° |
C26 | C27 | H272 | 103.5° | 109.8° |
H261 | C26 | H262 | 111.5° | 107.4° |
H271 | C27 | H272 | 118.5° | 107.3° |
O2 | C2 | C3 | 111.5° | 109.3° |
O2 | C2 | H2 | 108.3° | 106.9° |
C2 | O2 | HO2 | 109.5° | 106.5° |
C3 | C2 | H2 | 108.1° | 110.5° |
C2 | C3 | O3 | 110.4° | 109.3° |
C2 | C3 | C4 | 110.3° | 111.0° |
C2 | C3 | H3 | 108.7° | 109.3° |
O3 | C3 | C4 | 110.6° | 110.3° |
O3 | C3 | H3 | 108.4° | 106.9° |
C3 | O3 | HO3 | 109.5° | 106.5° |
C4 | C3 | H3 | 108.4° | 110.0° |
C3 | C4 | O4 | 108.9° | 108.5° |
C3 | C4 | C5 | 108.9° | 109.8° |
C3 | C4 | H4 | 111.0° | 109.9° |
O4 | C4 | C5 | 111.8° | 110.0° |
O4 | C4 | H4 | 108.1° | 107.2° |
C4 | O4 | HO4 | 109.5° | 106.3° |
C5 | C4 | H4 | 108.1° | 111.4° |
C4 | C5 | C6 | 111.5° | 113.0° |
C4 | C5 | O5 | 112.0° | 109.9° |
C4 | C5 | H5 | 106.2° | 109.7° |
C6 | C5 | O5 | 109.1° | 107.4° |
C6 | C5 | H5 | 109.3° | 108.2° |
C5 | C6 | O6 | 111.0° | 108.7° |
C5 | C6 | H61 | 109.0° | 110.0° |
C5 | C6 | H62 | 108.6° | 110.1° |
O5 | C5 | H5 | 108.7° | 108.6° |
O6 | C6 | H61 | 109.0° | 109.2° |
O6 | C6 | H62 | 108.6° | 109.2° |
C6 | O6 | HO6 | 109.5° | 107.0° |
H61 | C6 | H62 | 110.6° | 109.6° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C1 | C2 | O5 | 113.9° | 121.8° |
O1 | C1 | C2 | H1 | 123.2° | 116.9° |
O1 | C1 | O5 | H1 | 122.8° | 115.7° |
C1 | O1 | C7 | C8 | 155.8° | 119.9° |
C1 | O1 | C7 | C12 | 22.0° | 60.0° |
O1 | C1 | C2 | O2 | 62.9° | 64.8° |
O1 | C1 | C2 | C3 | 175.0° | 175.3° |
O1 | C1 | C2 | H2 | 56.1° | 52.2° |
O1 | C1 | O5 | C5 | 177.1° | 177.7° |
C2 | C1 | O5 | H1 | 120.1° | 122.4° |
C2 | C1 | O1 | C7 | 155.0° | 149.9° |
C1 | C2 | O2 | C3 | 120.6° | 120.8° |
C1 | C2 | O2 | H2 | 120.5° | 119.5° |
C1 | C2 | C3 | H2 | 120.5° | 123.2° |
C1 | C2 | O2 | HO2 | 159.1° | 32.0° |
C1 | C2 | C3 | O3 | 176.1° | 172.6° |
C1 | C2 | C3 | C4 | 53.6° | 50.7° |
C1 | C2 | C3 | H3 | 65.2° | 70.8° |
C2 | C1 | O5 | C5 | 65.8° | 60.4° |
O5 | C1 | O1 | C7 | 87.6° | 87.6° |
O5 | C1 | C2 | O2 | 176.9° | 173.4° |
O5 | C1 | C2 | C3 | 61.1° | 53.5° |
O5 | C1 | C2 | H2 | 57.8° | 69.5° |
C1 | O5 | C5 | C4 | 63.9° | 62.2° |
C1 | O5 | C5 | C6 | 172.2° | 174.5° |
C1 | O5 | C5 | H5 | 53.1° | 57.8° |
H1 | C1 | O1 | C7 | 35.0° | 30.0° |
H1 | C1 | C2 | O2 | 60.3° | 52.1° |
H1 | C1 | C2 | C3 | 61.8° | 67.8° |
H1 | C1 | C2 | H2 | 179.3° | 169.1° |
H1 | C1 | O5 | C5 | 54.3° | 62.0° |
O1 | C7 | C8 | C12 | 177.9° | 180.0° |
O1 | C7 | C8 | C9 | 178.7° | 180.0° |
O1 | C7 | C8 | H8 | 1.3° | 0.0° |
O1 | C7 | C12 | C11 | 179.0° | 180.0° |
O1 | C7 | C12 | H12 | 1.0° | 0.0° |
C7 | C8 | C9 | H8 | 180.0° | 180.0° |
C7 | C8 | C9 | N14 | 179.7° | 180.0° |
C7 | C8 | C9 | C10 | 0.1° | 0.0° |
C8 | C7 | C12 | C11 | 1.3° | 0.0° |
C8 | C7 | C12 | H12 | 178.7° | 180.0° |
C12 | C7 | C8 | C9 | 0.9° | 0.0° |
C12 | C7 | C8 | H8 | 179.1° | 180.0° |
C7 | C12 | C11 | C10 | 0.9° | 0.0° |
C7 | C12 | C11 | H12 | 180.0° | 180.0° |
C7 | C12 | C11 | C13 | 179.7° | 179.9° |
C8 | C9 | N14 | C10 | 179.8° | 180.0° |
C8 | C9 | N14 | O15 | 179.8° | 180.0° |
C8 | C9 | N14 | O16 | 0.5° | 0.0° |
C8 | C9 | C10 | C11 | 0.3° | 0.0° |
C8 | C9 | C10 | H10 | 179.7° | 180.0° |
H8 | C8 | C9 | N14 | 0.3° | 0.0° |
H8 | C8 | C9 | C10 | 179.9° | 180.0° |
C9 | N14 | O15 | O16 | 179.6° | 180.0° |
N14 | C9 | C10 | C11 | 179.9° | 180.0° |
N14 | C9 | C10 | H10 | 0.1° | 0.0° |
C10 | C9 | N14 | O15 | 0.1° | 0.0° |
C10 | C9 | N14 | O16 | 179.7° | 180.0° |
C9 | C10 | C11 | H10 | 180.0° | 179.9° |
C9 | C10 | C11 | C12 | 0.1° | 0.0° |
C9 | C10 | C11 | C13 | 179.0° | 179.9° |
C10 | C11 | C12 | C13 | 178.9° | 179.9° |
C10 | C11 | C12 | H12 | 179.1° | 180.0° |
C10 | C11 | C13 | N18 | 26.9° | 153.1° |
C10 | C11 | C13 | O17 | 153.8° | 25.8° |
H10 | C10 | C11 | C12 | 179.9° | 179.9° |
H10 | C10 | C11 | C13 | 1.1° | 0.0° |
C12 | C11 | C13 | N18 | 154.3° | 27.0° |
C12 | C11 | C13 | O17 | 25.1° | 154.1° |
C13 | C11 | C12 | H12 | 0.2° | 0.1° |
C11 | C13 | N18 | O17 | 179.3° | 178.8° |
C11 | C13 | N18 | C19 | 179.6° | 178.9° |
C11 | C13 | N18 | H18 | 0.4° | 3.0° |
C13 | N18 | C19 | H18 | 180.0° | 176.0° |
C13 | N18 | C19 | C20 | 103.3° | 90.1° |
C13 | N18 | C19 | H191 | 16.7° | 149.2° |
C13 | N18 | C19 | H192 | 136.9° | 33.4° |
O17 | C13 | N18 | C19 | 1.1° | 0.1° |
O17 | C13 | N18 | H18 | 178.9° | 175.8° |
N18 | C19 | C20 | H191 | 120.0° | 119.0° |
N18 | C19 | C20 | H192 | 119.8° | 121.3° |
N18 | C19 | H191 | H192 | 119.8° | 115.8° |
N18 | C19 | C20 | C21 | 124.3° | 58.9° |
N18 | C19 | C20 | H201 | 115.7° | 179.5° |
N18 | C19 | C20 | H202 | 4.7° | 63.0° |
H18 | N18 | C19 | C20 | 76.7° | 85.9° |
H18 | N18 | C19 | H191 | 163.3° | 34.8° |
H18 | N18 | C19 | H192 | 43.1° | 150.7° |
C20 | C19 | H191 | H192 | 119.8° | 121.8° |
C19 | C20 | C21 | H201 | 120.0° | 122.0° |
C19 | C20 | C21 | H202 | 119.6° | 121.6° |
C19 | C20 | H201 | H202 | 119.6° | 117.4° |
C19 | C20 | C21 | N22 | 154.4° | 58.7° |
C19 | C20 | C21 | H211 | 85.6° | 180.0° |
C19 | C20 | C21 | H212 | 39.0° | 60.2° |
H191 | C19 | C20 | C21 | 4.2° | 60.0° |
H191 | C19 | C20 | H201 | 124.2° | 61.6° |
H191 | C19 | C20 | H202 | 115.3° | 178.0° |
H192 | C19 | C20 | C21 | 115.9° | 179.7° |
H192 | C19 | C20 | H201 | 4.0° | 58.1° |
H192 | C19 | C20 | H202 | 124.5° | 58.3° |
C21 | C20 | H201 | H202 | 119.5° | 117.8° |
C20 | C21 | N22 | H211 | 120.0° | 123.4° |
C20 | C21 | N22 | H212 | 115.4° | 120.7° |
C20 | C21 | H211 | H212 | 116.1° | 120.8° |
C20 | C21 | N22 | C23 | 49.1° | 63.4° |
C20 | C21 | N22 | C27 | 172.6° | 173.6° |
H201 | C20 | C21 | N22 | 34.4° | 63.3° |
H201 | C20 | C21 | H211 | 154.4° | 58.0° |
H201 | C20 | C21 | H212 | 81.0° | 177.7° |
H202 | C20 | C21 | N22 | 86.1° | 179.7° |
H202 | C20 | C21 | H211 | 33.9° | 58.4° |
H202 | C20 | C21 | H212 | 158.6° | 61.3° |
N22 | C21 | H211 | H212 | 116.0° | 115.2° |
C21 | N22 | C23 | C27 | 120.0° | 123.2° |
C21 | N22 | C23 | C24 | 156.5° | 179.9° |
C21 | N22 | C23 | H231 | 36.5° | 57.8° |
C21 | N22 | C23 | H232 | 85.2° | 60.3° |
C21 | N22 | C27 | C26 | 150.1° | 180.0° |
C21 | N22 | C27 | H271 | 89.9° | 60.3° |
C21 | N22 | C27 | H272 | 35.4° | 57.9° |
H211 | C21 | N22 | C23 | 169.1° | 60.0° |
H211 | C21 | N22 | C27 | 67.4° | 63.0° |
H212 | C21 | N22 | C23 | 66.3° | 175.9° |
H212 | C21 | N22 | C27 | 57.2° | 52.9° |
N22 | C23 | C24 | H231 | 120.0° | 122.6° |
N22 | C23 | C24 | H232 | 118.3° | 120.4° |
N22 | C23 | H231 | H232 | 118.4° | 119.5° |
N22 | C23 | C24 | N25 | 58.0° | 56.9° |
N22 | C23 | C24 | H241 | 178.0° | 65.8° |
N22 | C23 | C24 | H242 | 61.0° | 177.3° |
C23 | N22 | C27 | C26 | 28.2° | 56.8° |
C23 | N22 | C27 | H271 | 148.2° | 176.5° |
C23 | N22 | C27 | H272 | 86.5° | 65.3° |
C27 | N22 | C23 | C24 | 36.5° | 56.7° |
C27 | N22 | C23 | H231 | 83.5° | 65.4° |
C27 | N22 | C23 | H232 | 154.8° | 176.5° |
N22 | C27 | C26 | N25 | 37.7° | 57.0° |
N22 | C27 | C26 | H271 | 120.0° | 120.4° |
N22 | C27 | C26 | H272 | 114.7° | 122.6° |
N22 | C27 | C26 | H261 | 157.7° | 177.3° |
N22 | C27 | C26 | H262 | 81.2° | 65.7° |
N22 | C27 | H271 | H272 | 115.5° | 120.3° |
C24 | C23 | H231 | H232 | 118.4° | 117.8° |
C23 | C24 | N25 | H241 | 120.0° | 122.1° |
C23 | C24 | N25 | H242 | 119.0° | 119.8° |
C23 | C24 | H241 | H242 | 119.0° | 117.7° |
C23 | C24 | N25 | C28 | 170.1° | 179.8° |
C23 | C24 | N25 | C26 | 65.8° | 56.7° |
H231 | C23 | C24 | N25 | 62.0° | 65.7° |
H231 | C23 | C24 | H241 | 58.0° | 171.6° |
H231 | C23 | C24 | H242 | 179.0° | 54.7° |
H232 | C23 | C24 | N25 | 176.2° | 177.3° |
H232 | C23 | C24 | H241 | 63.8° | 54.6° |
H232 | C23 | C24 | H242 | 57.2° | 62.3° |
N25 | C24 | H241 | H242 | 119.0° | 119.5° |
C24 | N25 | C28 | C26 | 121.4° | 123.0° |
C24 | N25 | C28 | C35 | 96.2° | 63.4° |
C24 | N25 | C28 | H281 | 23.8° | 60.0° |
C24 | N25 | C28 | H282 | 145.3° | 175.8° |
C24 | N25 | C26 | C27 | 54.0° | 56.7° |
C24 | N25 | C26 | H261 | 174.0° | 176.4° |
C24 | N25 | C26 | H262 | 64.9° | 65.3° |
H241 | C24 | N25 | C28 | 50.1° | 57.8° |
H241 | C24 | N25 | C26 | 174.2° | 65.4° |
H242 | C24 | N25 | C28 | 70.9° | 60.4° |
H242 | C24 | N25 | C26 | 53.1° | 176.5° |
N25 | C28 | C35 | H281 | 120.0° | 121.3° |
N25 | C28 | C35 | H282 | 118.5° | 119.0° |
N25 | C28 | H281 | H282 | 118.6° | 115.1° |
N25 | C28 | C35 | C36 | 123.8° | 58.7° |
N25 | C28 | C35 | H351 | 116.2° | 63.3° |
N25 | C28 | C35 | H352 | 6.5° | 179.8° |
C28 | N25 | C26 | C27 | 178.0° | 179.9° |
C28 | N25 | C26 | H261 | 62.0° | 60.5° |
C28 | N25 | C26 | H262 | 59.1° | 57.8° |
C26 | N25 | C28 | C35 | 142.4° | 173.7° |
C26 | N25 | C28 | H281 | 97.6° | 63.0° |
C26 | N25 | C28 | H282 | 23.9° | 52.9° |
N25 | C26 | C27 | H261 | 120.0° | 120.3° |
N25 | C26 | C27 | H262 | 118.9° | 122.7° |
N25 | C26 | H261 | H262 | 118.9° | 120.4° |
N25 | C26 | C27 | H271 | 157.7° | 177.4° |
N25 | C26 | C27 | H272 | 76.9° | 65.6° |
C35 | C28 | H281 | H282 | 118.6° | 120.9° |
C28 | C35 | C36 | H351 | 120.0° | 121.6° |
C28 | C35 | C36 | H352 | 117.3° | 122.0° |
C28 | C35 | H351 | H352 | 117.6° | 117.9° |
C28 | C35 | C36 | N37 | 151.3° | 179.0° |
C28 | C35 | C36 | H361 | 31.3° | 60.0° |
C28 | C35 | C36 | H362 | 89.5° | 59.7° |
H281 | C28 | C35 | C36 | 3.8° | 180.0° |
H281 | C28 | C35 | H351 | 123.8° | 58.0° |
H281 | C28 | C35 | H352 | 113.5° | 58.5° |
H282 | C28 | C35 | C36 | 117.7° | 60.3° |
H282 | C28 | C35 | H351 | 2.3° | 177.7° |
H282 | C28 | C35 | H352 | 125.1° | 61.3° |
C36 | C35 | H351 | H352 | 117.5° | 117.4° |
C35 | C36 | N37 | H361 | 120.0° | 120.7° |
C35 | C36 | N37 | H362 | 119.1° | 123.4° |
C35 | C36 | H361 | H362 | 119.1° | 121.8° |
C35 | C36 | N37 | H371 | 46.4° | 117.3° |
C35 | C36 | N37 | H372 | 166.4° | 49.2° |
H351 | C35 | C36 | N37 | 88.7° | 59.4° |
H351 | C35 | C36 | H361 | 151.3° | 178.4° |
H351 | C35 | C36 | H362 | 30.5° | 61.9° |
H352 | C35 | C36 | N37 | 34.0° | 57.0° |
H352 | C35 | C36 | H361 | 86.0° | 62.0° |
H352 | C35 | C36 | H362 | 153.1° | 178.3° |
N37 | C36 | H361 | H362 | 119.2° | 115.8° |
C36 | N37 | H371 | H372 | 120.0° | 166.4° |
H361 | C36 | N37 | H371 | 73.6° | 122.0° |
H361 | C36 | N37 | H372 | 46.5° | 71.5° |
H362 | C36 | N37 | H371 | 165.5° | 6.0° |
H362 | C36 | N37 | H372 | 74.4° | 172.6° |
C27 | C26 | H261 | H262 | 119.0° | 118.5° |
C26 | C27 | H271 | H272 | 115.5° | 118.6° |
H261 | C26 | C27 | H271 | 82.3° | 62.3° |
H261 | C26 | C27 | H272 | 43.1° | 54.7° |
H262 | C26 | C27 | H271 | 38.8° | 54.7° |
H262 | C26 | C27 | H272 | 164.2° | 171.7° |
O2 | C2 | C3 | H2 | 119.0° | 117.4° |
O2 | C2 | C3 | O3 | 63.4° | 68.1° |
O2 | C2 | C3 | C4 | 174.1° | 170.1° |
O2 | C2 | C3 | H3 | 55.4° | 48.6° |
C3 | C2 | O2 | HO2 | 80.3° | 152.8° |
C2 | C3 | O3 | C4 | 122.4° | 122.3° |
C2 | C3 | O3 | H3 | 118.9° | 118.2° |
C2 | C3 | C4 | H3 | 118.9° | 121.1° |
C2 | C3 | O3 | HO3 | 137.6° | 27.4° |
C2 | C3 | C4 | O4 | 71.7° | 67.8° |
C2 | C3 | C4 | C5 | 50.5° | 52.5° |
C2 | C3 | C4 | H4 | 169.4° | 175.4° |
H2 | C2 | O2 | HO2 | 38.6° | 87.6° |
H2 | C2 | C3 | O3 | 55.6° | 49.3° |
H2 | C2 | C3 | C4 | 66.9° | 72.5° |
H2 | C2 | C3 | H3 | 174.3° | 166.0° |
O3 | C3 | C4 | H3 | 118.7° | 117.6° |
O3 | C3 | C4 | O4 | 50.8° | 53.5° |
O3 | C3 | C4 | C5 | 173.0° | 173.8° |
O3 | C3 | C4 | H4 | 68.2° | 63.4° |
C4 | C3 | O3 | HO3 | 100.0° | 149.7° |
C3 | C4 | O4 | C5 | 120.4° | 120.2° |
C3 | C4 | O4 | H4 | 120.7° | 118.6° |
C3 | C4 | C5 | H4 | 120.7° | 121.9° |
C3 | C4 | O4 | HO4 | 60.7° | 40.8° |
C3 | C4 | C5 | C6 | 178.2° | 177.0° |
C3 | C4 | C5 | O5 | 55.7° | 57.1° |
C3 | C4 | C5 | H5 | 62.9° | 62.2° |
H3 | C3 | O3 | HO3 | 18.7° | 90.8° |
H3 | C3 | C4 | O4 | 169.4° | 171.1° |
H3 | C3 | C4 | C5 | 68.4° | 68.6° |
H3 | C3 | C4 | H4 | 50.5° | 54.2° |
O4 | C4 | C5 | H4 | 118.9° | 118.7° |
O4 | C4 | C5 | C6 | 57.8° | 57.6° |
O4 | C4 | C5 | O5 | 64.8° | 62.3° |
O4 | C4 | C5 | H5 | 176.7° | 178.4° |
C5 | C4 | O4 | HO4 | 178.8° | 79.4° |
C4 | C5 | C6 | O5 | 124.2° | 121.3° |
C4 | C5 | C6 | H5 | 117.0° | 121.7° |
C4 | C5 | O5 | H5 | 117.0° | 120.0° |
C4 | C5 | C6 | O6 | 171.7° | 179.5° |
C4 | C5 | C6 | H61 | 51.7° | 60.0° |
C4 | C5 | C6 | H62 | 68.9° | 60.9° |
H4 | C4 | O4 | HO4 | 60.0° | 159.4° |
H4 | C4 | C5 | C6 | 61.0° | 61.1° |
H4 | C4 | C5 | O5 | 176.4° | 179.1° |
H4 | C4 | C5 | H5 | 57.9° | 59.7° |
C6 | C5 | O5 | H5 | 119.1° | 116.7° |
C5 | C6 | O6 | H61 | 120.0° | 120.1° |
C5 | C6 | O6 | H62 | 119.4° | 120.1° |
C5 | C6 | H61 | H62 | 119.4° | 121.2° |
C5 | C6 | O6 | HO6 | 102.6° | 7.7° |
O5 | C5 | C6 | O6 | 64.1° | 58.2° |
O5 | C5 | C6 | H61 | 175.9° | 61.3° |
O5 | C5 | C6 | H62 | 55.3° | 177.8° |
H5 | C5 | C6 | O6 | 54.7° | 58.8° |
H5 | C5 | C6 | H61 | 65.3° | 178.3° |
H5 | C5 | C6 | H62 | 174.1° | 60.8° |
O6 | C6 | H61 | H62 | 119.4° | 119.6° |
H61 | C6 | O6 | HO6 | 137.4° | 112.3° |
H62 | C6 | O6 | HO6 | 16.8° | 127.8° |