26W
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3' | C3' | sing | 1.43Å | 1.45Å | |
O4' | C4' | sing | 1.43Å | 1.43Å | |
C3' | C4' | sing | 1.53Å | 1.51Å | |
C3' | C2' | sing | 1.53Å | 1.56Å | |
C4' | C5' | sing | 1.53Å | 1.59Å | |
O2' | C2' | sing | 1.43Å | 1.41Å | |
C2' | C1' | sing | 1.53Å | 1.54Å | |
O6' | C6' | sing | 1.43Å | 1.44Å | |
C5' | C6' | sing | 1.53Å | 1.52Å | |
C5' | O5' | sing | 1.43Å | 1.45Å | |
C1' | O5' | sing | 1.43Å | 1.45Å | |
C1' | N1 | sing | 1.46Å | 1.48Å | |
N1 | C2 | sing | 1.35Å | 1.35Å | |
C2 | O3 | doub | 1.21Å | 1.23Å | |
C2 | C4 | sing | 1.51Å | 1.55Å | |
C4 | C5 | sing | 1.53Å | 1.50Å | |
C6 | C5 | sing | 1.53Å | 1.52Å | |
C5 | C7 | sing | 1.51Å | 1.42Å | |
C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
C8 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
C7 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
C9 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
C12 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
C10 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
C10 | C13 | sing | 1.51Å | 1.42Å | |
C13 | C14 | sing | 1.53Å | 1.54Å | |
C14 | H1 | sing | 1.09Å | 1.10Å | |
C14 | H2 | sing | 1.09Å | 1.10Å | |
C14 | H3 | sing | 1.09Å | 1.10Å | |
C13 | H4 | sing | 1.09Å | 1.10Å | |
C13 | H5 | sing | 1.09Å | 1.10Å | |
C11 | H6 | sing | 1.08Å | 1.08Å | |
C12 | H7 | sing | 1.08Å | 1.08Å | |
C9 | H8 | sing | 1.08Å | 1.08Å | |
C8 | H9 | sing | 1.08Å | 1.08Å | |
C5 | H10 | sing | 1.09Å | 1.10Å | |
C6 | H11 | sing | 1.09Å | 1.10Å | |
C6 | H12 | sing | 1.09Å | 1.10Å | |
C6 | H13 | sing | 1.09Å | 1.10Å | |
C4 | H14 | sing | 1.09Å | 1.10Å | |
C4 | H15 | sing | 1.09Å | 1.10Å | |
N1 | H16 | sing | 0.97Å | 1.00Å | |
C1' | H17 | sing | 1.09Å | 1.10Å | |
C5' | H18 | sing | 1.09Å | 1.10Å | |
C6' | H19 | sing | 1.09Å | 1.10Å | |
C6' | H20 | sing | 1.09Å | 1.10Å | |
O6' | H21 | sing | 0.97Å | 0.95Å | |
C4' | H22 | sing | 1.09Å | 1.10Å | |
O4' | H23 | sing | 0.97Å | 0.95Å | |
C3' | H24 | sing | 1.09Å | 1.10Å | |
O3' | H25 | sing | 0.97Å | 0.95Å | |
C2' | H26 | sing | 1.09Å | 1.10Å | |
O2' | H27 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3' | C3' | C4' | 109.2° | 109.5° |
O3' | C3' | C2' | 109.2° | 109.6° |
O3' | C3' | H24 | 110.3° | 109.6° |
C3' | O3' | H25 | 109.5° | 114.0° |
O4' | C4' | C3' | 109.9° | 109.6° |
O4' | C4' | C5' | 110.7° | 109.5° |
O4' | C4' | H22 | 109.0° | 109.6° |
C4' | O4' | H23 | 109.5° | 114.0° |
C4' | C3' | C2' | 109.9° | 109.0° |
C3' | C4' | C5' | 112.2° | 109.2° |
C3' | C4' | H22 | 107.9° | 109.5° |
C4' | C3' | H24 | 109.4° | 109.6° |
C3' | C2' | O2' | 110.3° | 109.5° |
C3' | C2' | C1' | 110.6° | 109.2° |
C2' | C3' | H24 | 108.8° | 109.5° |
C3' | C2' | H26 | 107.9° | 109.5° |
C4' | C5' | C6' | 112.7° | 109.5° |
C4' | C5' | O5' | 110.2° | 109.4° |
C4' | C5' | H18 | 107.3° | 109.5° |
C5' | C4' | H22 | 107.0° | 109.5° |
O2' | C2' | C1' | 110.1° | 109.5° |
O2' | C2' | H26 | 109.8° | 109.6° |
C2' | O2' | H27 | 109.5° | 114.0° |
C2' | C1' | O5' | 108.9° | 109.4° |
C2' | C1' | N1 | 108.7° | 109.5° |
C2' | C1' | H17 | 107.5° | 109.5° |
C1' | C2' | H26 | 108.1° | 109.6° |
O6' | C6' | C5' | 108.3° | 109.5° |
O6' | C6' | H19 | 109.8° | 109.5° |
O6' | C6' | H20 | 109.8° | 109.5° |
C6' | O6' | H21 | 109.5° | 114.0° |
C6' | C5' | O5' | 109.3° | 109.5° |
C6' | C5' | H18 | 108.1° | 109.4° |
C5' | C6' | H19 | 109.8° | 109.4° |
C5' | C6' | H20 | 109.8° | 109.5° |
C5' | O5' | C1' | 109.7° | 114.1° |
O5' | C5' | H18 | 109.1° | 109.5° |
O5' | C1' | N1 | 114.8° | 109.5° |
O5' | C1' | H17 | 108.6° | 109.5° |
C1' | N1 | C2 | 119.6° | 120.0° |
C1' | N1 | H16 | 120.2° | 120.1° |
N1 | C1' | H17 | 108.2° | 109.5° |
N1 | C2 | O3 | 123.3° | 120.0° |
N1 | C2 | C4 | 117.8° | 120.0° |
C2 | N1 | H16 | 120.2° | 119.9° |
O3 | C2 | C4 | 118.8° | 120.0° |
C2 | C4 | C5 | 110.5° | 109.5° |
C2 | C4 | H14 | 109.2° | 109.5° |
C2 | C4 | H15 | 109.2° | 109.5° |
C4 | C5 | C6 | 111.9° | 109.5° |
C4 | C5 | C7 | 108.2° | 109.5° |
C4 | C5 | H10 | 108.5° | 109.4° |
C5 | C4 | H14 | 109.2° | 109.5° |
C5 | C4 | H15 | 109.2° | 109.5° |
C6 | C5 | C7 | 110.3° | 109.5° |
C6 | C5 | H10 | 108.3° | 109.5° |
C5 | C6 | H11 | 109.5° | 109.5° |
C5 | C6 | H12 | 109.5° | 109.5° |
C5 | C6 | H13 | 109.5° | 109.5° |
C5 | C7 | C8 | 120.3° | 120.0° |
C5 | C7 | C12 | 120.4° | 120.0° |
C7 | C5 | H10 | 109.6° | 109.5° |
C7 | C8 | C9 | 119.9° | 120.0° |
C8 | C7 | C12 | 119.2° | 120.0° |
C7 | C8 | H9 | 120.1° | 120.0° |
C8 | C9 | C10 | 121.3° | 120.1° |
C8 | C9 | H8 | 119.3° | 120.0° |
C9 | C8 | H9 | 120.0° | 120.0° |
C7 | C12 | C11 | 120.6° | 120.0° |
C7 | C12 | H7 | 119.7° | 120.0° |
C9 | C10 | C11 | 118.6° | 119.9° |
C9 | C10 | C13 | 119.5° | 120.0° |
C10 | C9 | H8 | 119.4° | 119.9° |
C12 | C11 | C10 | 120.3° | 120.0° |
C12 | C11 | H6 | 119.9° | 120.1° |
C11 | C12 | H7 | 119.7° | 120.0° |
C11 | C10 | C13 | 121.8° | 120.0° |
C10 | C11 | H6 | 119.8° | 119.9° |
C10 | C13 | C14 | 111.6° | 109.5° |
C10 | C13 | H4 | 108.9° | 109.5° |
C10 | C13 | H5 | 108.9° | 109.4° |
C13 | C14 | H1 | 109.5° | 109.4° |
C13 | C14 | H2 | 109.5° | 109.5° |
C13 | C14 | H3 | 109.5° | 109.4° |
C14 | C13 | H4 | 109.0° | 109.5° |
C14 | C13 | H5 | 108.9° | 109.5° |
H1 | C14 | H2 | 109.5° | 109.5° |
H1 | C14 | H3 | 109.4° | 109.5° |
H2 | C14 | H3 | 109.5° | 109.5° |
H4 | C13 | H5 | 109.5° | 109.4° |
H11 | C6 | H12 | 109.5° | 109.5° |
H11 | C6 | H13 | 109.5° | 109.5° |
H12 | C6 | H13 | 109.4° | 109.5° |
H14 | C4 | H15 | 109.5° | 109.5° |
H19 | C6' | H20 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3' | C3' | C4' | O4' | 69.1° | 63.2° |
O3' | C3' | C4' | C2' | 119.8° | 119.9° |
O3' | C3' | C4' | H24 | 120.8° | 120.2° |
O3' | C3' | C2' | H24 | 120.4° | 120.2° |
O3' | C3' | C4' | C5' | 167.3° | 176.9° |
O3' | C3' | C2' | O2' | 66.4° | 63.2° |
O3' | C3' | C2' | C1' | 171.6° | 176.9° |
O3' | C3' | C4' | H22 | 49.6° | 57.0° |
O3' | C3' | C2' | H26 | 53.6° | 56.9° |
O4' | C4' | C3' | C5' | 123.6° | 119.9° |
O4' | C4' | C3' | H22 | 118.7° | 120.2° |
O4' | C4' | C3' | C2' | 171.2° | 176.9° |
O4' | C4' | C5' | H22 | 118.7° | 120.2° |
O4' | C4' | C5' | C6' | 60.8° | 62.5° |
O4' | C4' | C5' | O5' | 176.8° | 177.6° |
O4' | C4' | C5' | H18 | 58.2° | 57.6° |
O4' | C4' | C3' | H24 | 51.7° | 57.0° |
C4' | C3' | C2' | H24 | 119.8° | 119.9° |
C3' | C4' | C5' | H22 | 118.2° | 119.9° |
C4' | C3' | C2' | O2' | 173.9° | 176.9° |
C4' | C3' | C2' | C1' | 51.8° | 57.0° |
C3' | C4' | C5' | C6' | 176.1° | 177.6° |
C3' | C4' | C5' | O5' | 53.7° | 57.6° |
C3' | C4' | C5' | H18 | 65.0° | 62.4° |
C3' | C4' | O4' | H23 | 180.0° | 60.3° |
C4' | C3' | O3' | H25 | 180.0° | 180.0° |
C4' | C3' | C2' | H26 | 66.2° | 62.9° |
C2' | C3' | C4' | C5' | 47.6° | 57.0° |
C3' | C2' | O2' | C1' | 122.3° | 119.7° |
C3' | C2' | O2' | H26 | 118.8° | 120.1° |
C3' | C2' | C1' | H26 | 117.9° | 119.9° |
C3' | C2' | C1' | O5' | 61.4° | 57.6° |
C3' | C2' | C1' | N1 | 172.9° | 177.6° |
C3' | C2' | C1' | H17 | 56.0° | 62.4° |
C2' | C3' | C4' | H22 | 70.1° | 62.9° |
C2' | C3' | O3' | H25 | 59.8° | 60.4° |
C3' | C2' | O2' | H27 | 180.0° | 179.9° |
C4' | C5' | C6' | O6' | 53.5° | 175.0° |
C4' | C5' | C6' | O5' | 122.9° | 120.0° |
C4' | C5' | C6' | H18 | 118.5° | 120.1° |
C4' | C5' | O5' | H18 | 117.6° | 120.0° |
C4' | C5' | O5' | C1' | 62.8° | 61.1° |
C4' | C5' | C6' | H19 | 66.3° | 55.0° |
C4' | C5' | C6' | H20 | 173.4° | 65.0° |
C5' | C4' | O4' | H23 | 55.6° | 180.0° |
C5' | C4' | C3' | H24 | 71.9° | 62.9° |
O2' | C2' | C1' | H26 | 120.0° | 120.2° |
O2' | C2' | C1' | O5' | 176.5° | 177.5° |
O2' | C2' | C1' | N1 | 50.8° | 62.5° |
O2' | C2' | C1' | H17 | 66.1° | 57.5° |
O2' | C2' | C3' | H24 | 54.0° | 57.0° |
C2' | C1' | O5' | C5' | 67.5° | 61.1° |
C2' | C1' | O5' | N1 | 122.1° | 120.0° |
C2' | C1' | O5' | H17 | 116.8° | 120.0° |
C2' | C1' | N1 | H17 | 116.5° | 120.1° |
C2' | C1' | N1 | C2 | 148.5° | 145.1° |
C2' | C1' | N1 | H16 | 31.6° | 34.9° |
C1' | C2' | C3' | H24 | 68.0° | 62.9° |
C1' | C2' | O2' | H27 | 57.7° | 60.3° |
O6' | C6' | C5' | H19 | 119.8° | 120.0° |
O6' | C6' | C5' | H20 | 119.8° | 120.0° |
O6' | C6' | C5' | O5' | 69.4° | 65.0° |
O6' | C6' | C5' | H18 | 172.0° | 55.0° |
O6' | C6' | H19 | H20 | 120.5° | 120.0° |
C6' | C5' | O5' | H18 | 118.0° | 120.0° |
C6' | C5' | O5' | C1' | 172.7° | 178.9° |
C5' | C6' | H19 | H20 | 120.5° | 120.0° |
C5' | C6' | O6' | H21 | 180.0° | 180.0° |
C6' | C5' | C4' | H22 | 57.9° | 57.7° |
C5' | O5' | C1' | N1 | 170.4° | 178.9° |
C5' | O5' | C1' | H17 | 49.2° | 58.9° |
O5' | C5' | C6' | H19 | 170.7° | 175.0° |
O5' | C5' | C6' | H20 | 50.4° | 55.0° |
O5' | C5' | C4' | H22 | 64.6° | 62.3° |
O5' | C1' | N1 | H17 | 121.4° | 120.0° |
O5' | C1' | N1 | C2 | 89.4° | 95.0° |
O5' | C1' | N1 | H16 | 90.6° | 85.0° |
C1' | O5' | C5' | H18 | 54.7° | 58.9° |
O5' | C1' | C2' | H26 | 56.5° | 62.3° |
C1' | N1 | C2 | H16 | 180.0° | 180.0° |
C1' | N1 | C2 | O3 | 0.9° | 0.0° |
C1' | N1 | C2 | C4 | 174.5° | 180.0° |
N1 | C1' | C2' | H26 | 69.2° | 57.7° |
N1 | C2 | O3 | C4 | 175.4° | 180.0° |
N1 | C2 | C4 | C5 | 101.1° | 180.0° |
N1 | C2 | C4 | H14 | 19.1° | 60.0° |
N1 | C2 | C4 | H15 | 138.7° | 60.0° |
C2 | N1 | C1' | H17 | 32.0° | 25.0° |
O3 | C2 | C4 | C5 | 83.2° | 0.0° |
O3 | C2 | C4 | H14 | 156.6° | 120.0° |
O3 | C2 | C4 | H15 | 36.9° | 120.0° |
O3 | C2 | N1 | H16 | 179.1° | 180.0° |
C2 | C4 | C5 | H14 | 120.2° | 120.0° |
C2 | C4 | C5 | H15 | 120.1° | 120.0° |
C2 | C4 | C5 | C6 | 68.6° | 65.0° |
C2 | C4 | C5 | C7 | 169.7° | 175.0° |
C2 | C4 | C5 | H10 | 50.9° | 55.0° |
C2 | C4 | H14 | H15 | 119.5° | 120.0° |
C4 | C2 | N1 | H16 | 5.5° | 0.0° |
C4 | C5 | C6 | C7 | 120.5° | 120.0° |
C4 | C5 | C6 | H10 | 119.6° | 120.0° |
C4 | C5 | C7 | H10 | 118.1° | 120.0° |
C4 | C5 | C7 | C8 | 76.5° | 120.0° |
C4 | C5 | C7 | C12 | 102.4° | 61.0° |
C4 | C5 | C6 | H11 | 180.0° | 60.0° |
C4 | C5 | C6 | H12 | 60.0° | 180.0° |
C4 | C5 | C6 | H13 | 60.0° | 60.0° |
C5 | C4 | H14 | H15 | 119.5° | 120.0° |
C6 | C5 | C7 | H10 | 119.2° | 120.0° |
C6 | C5 | C7 | C8 | 46.3° | 120.0° |
C6 | C5 | C7 | C12 | 134.8° | 59.0° |
C5 | C6 | H11 | H12 | 120.0° | 120.0° |
C5 | C6 | H11 | H13 | 120.0° | 120.0° |
C5 | C6 | H12 | H13 | 120.0° | 120.0° |
C6 | C5 | C4 | H14 | 51.6° | 175.0° |
C6 | C5 | C4 | H15 | 171.3° | 55.0° |
C5 | C7 | C8 | C12 | 178.9° | 179.0° |
C5 | C7 | C8 | C9 | 179.6° | 180.0° |
C5 | C7 | C12 | C11 | 179.7° | 179.7° |
C5 | C7 | C12 | H7 | 0.3° | 0.4° |
C5 | C7 | C8 | H9 | 0.4° | 1.0° |
C7 | C5 | C6 | H11 | 59.5° | 60.0° |
C7 | C5 | C6 | H12 | 179.5° | 60.0° |
C7 | C5 | C6 | H13 | 60.5° | 180.0° |
C7 | C5 | C4 | H14 | 70.2° | 55.0° |
C7 | C5 | C4 | H15 | 49.5° | 65.0° |
C7 | C8 | C9 | H9 | 180.0° | 179.0° |
C7 | C8 | C9 | C10 | 0.4° | 0.7° |
C8 | C7 | C12 | C11 | 1.4° | 0.6° |
C8 | C7 | C12 | H7 | 178.6° | 179.4° |
C7 | C8 | C9 | H8 | 179.6° | 179.3° |
C8 | C7 | C5 | H10 | 165.4° | 0.0° |
C9 | C8 | C7 | C12 | 0.7° | 1.0° |
C8 | C9 | C10 | H8 | 180.0° | 180.0° |
C8 | C9 | C10 | C11 | 0.9° | 0.0° |
C8 | C9 | C10 | C13 | 179.9° | 179.7° |
C7 | C12 | C11 | H7 | 180.0° | 180.0° |
C7 | C12 | C11 | C10 | 1.0° | 0.0° |
C7 | C12 | C11 | H6 | 179.0° | 179.9° |
C12 | C7 | C8 | H9 | 179.3° | 180.0° |
C12 | C7 | C5 | H10 | 15.7° | 179.1° |
C9 | C10 | C11 | C12 | 0.1° | 0.3° |
C9 | C10 | C11 | C13 | 179.0° | 179.8° |
C9 | C10 | C13 | C14 | 60.5° | 90.3° |
C9 | C10 | C13 | H4 | 59.9° | 149.7° |
C9 | C10 | C13 | H5 | 179.2° | 29.8° |
C9 | C10 | C11 | H6 | 179.8° | 179.7° |
C10 | C9 | C8 | H9 | 179.6° | 179.7° |
C12 | C11 | C10 | H6 | 180.0° | 180.0° |
C12 | C11 | C10 | C13 | 179.2° | 180.0° |
C11 | C10 | C13 | C14 | 120.5° | 90.0° |
C11 | C10 | C13 | H4 | 119.2° | 30.0° |
C11 | C10 | C13 | H5 | 0.2° | 150.0° |
C10 | C11 | C12 | H7 | 179.0° | 180.0° |
C11 | C10 | C9 | H8 | 179.1° | 180.0° |
C10 | C13 | C14 | H4 | 120.3° | 120.0° |
C10 | C13 | C14 | H5 | 120.3° | 120.0° |
C10 | C13 | C14 | H1 | 180.0° | 180.0° |
C10 | C13 | C14 | H2 | 60.0° | 60.0° |
C10 | C13 | C14 | H3 | 60.0° | 60.0° |
C10 | C13 | H4 | H5 | 119.0° | 119.9° |
C13 | C10 | C11 | H6 | 0.8° | 0.0° |
C13 | C10 | C9 | H8 | 0.1° | 0.3° |
C13 | C14 | H1 | H2 | 120.0° | 120.0° |
C13 | C14 | H1 | H3 | 120.0° | 120.0° |
C13 | C14 | H2 | H3 | 120.0° | 120.0° |
C14 | C13 | H4 | H5 | 119.0° | 120.0° |
H1 | C14 | H2 | H3 | 120.0° | 120.1° |
H1 | C14 | C13 | H4 | 59.7° | 60.0° |
H1 | C14 | C13 | H5 | 59.7° | 60.0° |
H2 | C14 | C13 | H4 | 179.7° | 60.0° |
H2 | C14 | C13 | H5 | 60.3° | 180.0° |
H3 | C14 | C13 | H4 | 60.3° | 180.0° |
H3 | C14 | C13 | H5 | 179.7° | 60.0° |
H6 | C11 | C12 | H7 | 1.0° | 0.0° |
H8 | C9 | C8 | H9 | 0.4° | 0.3° |
H10 | C5 | C6 | H11 | 60.4° | 179.9° |
H10 | C5 | C6 | H12 | 59.6° | 60.0° |
H10 | C5 | C6 | H13 | 179.6° | 59.9° |
H10 | C5 | C4 | H14 | 171.1° | 65.0° |
H10 | C5 | C4 | H15 | 69.2° | 175.0° |
H11 | C6 | H12 | H13 | 120.0° | 120.0° |
H16 | N1 | C1' | H17 | 148.0° | 155.0° |
H17 | C1' | C2' | H26 | 173.9° | 177.7° |
H18 | C5' | C6' | H19 | 52.1° | 65.0° |
H18 | C5' | C6' | H20 | 68.2° | 175.0° |
H18 | C5' | C4' | H22 | 176.8° | 177.7° |
H19 | C6' | O6' | H21 | 60.1° | 60.1° |
H20 | C6' | O6' | H21 | 60.2° | 60.0° |
H22 | C4' | O4' | H23 | 61.9° | 59.8° |
H22 | C4' | C3' | H24 | 170.4° | 177.2° |
H24 | C3' | O3' | H25 | 59.7° | 59.8° |
H24 | C3' | C2' | H26 | 174.0° | 177.2° |
H26 | C2' | O2' | H27 | 61.2° | 59.9° |