RH7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C08 | C07 | sing | 1.55Å | 1.34Å | |
C08 | C09 | sing | 1.55Å | 1.40Å | |
N17 | C16 | doub | 1.32Å | 1.32Å | Aromatic |
N17 | C18 | sing | 1.32Å | 1.35Å | Aromatic |
C16 | C15 | sing | 1.38Å | 1.42Å | Aromatic |
C07 | C06 | sing | 1.54Å | 1.64Å | |
C07 | C11 | sing | 1.55Å | 1.43Å | |
C06 | N05 | sing | 1.47Å | 1.51Å | |
C09 | C18 | sing | 1.51Å | 1.44Å | |
C09 | O10 | sing | 1.45Å | 1.65Å | |
C18 | C13 | doub | 1.38Å | 1.51Å | Aromatic |
C15 | N14 | doub | 1.32Å | 1.36Å | Aromatic |
C13 | N14 | sing | 1.32Å | 1.36Å | Aromatic |
C13 | C12 | sing | 1.51Å | 1.57Å | |
O04 | C03 | doub | 1.22Å | 1.17Å | |
N05 | C03 | sing | 1.35Å | 1.41Å | |
N05 | C19 | sing | 1.47Å | 1.51Å | |
C11 | O10 | sing | 1.44Å | 1.57Å | |
C11 | C12 | sing | 1.52Å | 1.55Å | |
C11 | C19 | sing | 1.52Å | 1.62Å | |
C03 | O02 | sing | 1.35Å | 1.39Å | |
O02 | C01 | sing | 1.45Å | 1.41Å | |
C15 | H1 | sing | 1.08Å | 1.08Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C01 | H4 | sing | 1.09Å | 1.10Å | |
C06 | H5 | sing | 1.09Å | 1.10Å | |
C06 | H6 | sing | 1.09Å | 1.10Å | |
C07 | H7 | sing | 1.09Å | 1.10Å | |
C08 | H8 | sing | 1.09Å | 1.10Å | |
C08 | H9 | sing | 1.09Å | 1.10Å | |
C09 | H10 | sing | 1.09Å | 1.10Å | |
C12 | H11 | sing | 1.09Å | 1.10Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C16 | H13 | sing | 1.08Å | 1.08Å | |
C19 | H14 | sing | 1.09Å | 1.10Å | |
C19 | H15 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C07 | C08 | C09 | 110.3° | 103.4° |
C08 | C07 | C06 | 110.9° | 108.9° |
C08 | C07 | C11 | 111.8° | 103.5° |
C08 | C07 | H7 | 111.4° | 113.8° |
C07 | C08 | H8 | 109.3° | 110.7° |
C07 | C08 | H9 | 109.3° | 110.6° |
C08 | C09 | C18 | 110.9° | 106.3° |
C08 | C09 | O10 | 101.9° | 103.8° |
C09 | C08 | H8 | 109.3° | 110.6° |
C09 | C08 | H9 | 109.3° | 110.6° |
C08 | C09 | H10 | 113.4° | 112.9° |
C16 | N17 | C18 | 119.9° | 120.0° |
N17 | C16 | C15 | 121.5° | 119.9° |
N17 | C16 | H13 | 119.2° | 120.0° |
N17 | C18 | C09 | 120.3° | 119.6° |
N17 | C18 | C13 | 120.4° | 120.2° |
C16 | C15 | N14 | 120.7° | 120.1° |
C16 | C15 | H1 | 119.7° | 119.9° |
C15 | C16 | H13 | 119.3° | 120.1° |
C06 | C07 | C11 | 105.2° | 103.0° |
C07 | C06 | N05 | 101.9° | 106.7° |
C07 | C06 | H5 | 111.3° | 110.0° |
C07 | C06 | H6 | 111.3° | 110.1° |
C06 | C07 | H7 | 107.3° | 113.2° |
C07 | C11 | O10 | 101.1° | 105.6° |
C07 | C11 | C12 | 114.8° | 111.2° |
C07 | C11 | C19 | 108.6° | 105.3° |
C11 | C07 | H7 | 110.0° | 113.5° |
C06 | N05 | C03 | 127.3° | 125.4° |
C06 | N05 | C19 | 111.5° | 109.2° |
N05 | C06 | H5 | 111.3° | 109.9° |
N05 | C06 | H6 | 111.3° | 110.0° |
C18 | C09 | O10 | 107.6° | 107.0° |
C09 | C18 | C13 | 119.3° | 120.2° |
C18 | C09 | H10 | 112.7° | 112.8° |
C09 | O10 | C11 | 94.2° | 103.9° |
O10 | C09 | H10 | 109.7° | 113.5° |
C18 | C13 | N14 | 117.0° | 119.9° |
C18 | C13 | C12 | 118.4° | 120.7° |
C15 | N14 | C13 | 120.4° | 120.0° |
N14 | C15 | H1 | 119.6° | 120.0° |
N14 | C13 | C12 | 124.5° | 119.4° |
C13 | C12 | C11 | 111.7° | 109.5° |
C13 | C12 | H11 | 108.9° | 109.5° |
C13 | C12 | H12 | 108.9° | 109.4° |
O04 | C03 | N05 | 119.8° | 120.0° |
O04 | C03 | O02 | 125.7° | 120.0° |
C03 | N05 | C19 | 121.1° | 125.4° |
N05 | C03 | O02 | 114.5° | 120.0° |
N05 | C19 | C11 | 103.1° | 107.7° |
N05 | C19 | H14 | 111.0° | 109.9° |
N05 | C19 | H15 | 111.0° | 109.9° |
O10 | C11 | C12 | 108.2° | 109.8° |
O10 | C11 | C19 | 111.0° | 111.7° |
C12 | C11 | C19 | 112.5° | 112.9° |
C11 | C12 | H11 | 108.9° | 109.5° |
C11 | C12 | H12 | 108.9° | 109.4° |
C11 | C19 | H14 | 111.1° | 109.8° |
C11 | C19 | H15 | 111.0° | 109.8° |
C03 | O02 | C01 | 113.0° | 117.0° |
O02 | C01 | H2 | 109.5° | 109.5° |
O02 | C01 | H3 | 109.5° | 109.5° |
O02 | C01 | H4 | 109.5° | 109.5° |
H2 | C01 | H3 | 109.4° | 109.5° |
H2 | C01 | H4 | 109.5° | 109.5° |
H3 | C01 | H4 | 109.5° | 109.4° |
H5 | C06 | H6 | 109.5° | 110.0° |
H8 | C08 | H9 | 109.4° | 110.7° |
H11 | C12 | H12 | 109.5° | 109.5° |
H14 | C19 | H15 | 109.5° | 109.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C07 | C08 | C09 | H8 | 120.1° | 118.5° |
C07 | C08 | C09 | H9 | 120.1° | 118.4° |
C08 | C07 | C06 | C11 | 121.0° | 109.5° |
C08 | C07 | C06 | H7 | 121.8° | 127.6° |
C08 | C07 | C11 | H7 | 124.2° | 123.8° |
C08 | C07 | C06 | N05 | 152.2° | 137.1° |
C07 | C08 | C09 | C18 | 88.7° | 82.9° |
C07 | C08 | C09 | O10 | 25.6° | 29.7° |
C08 | C07 | C11 | O10 | 31.3° | 21.6° |
C08 | C07 | C11 | C12 | 84.9° | 97.5° |
C08 | C07 | C11 | C19 | 148.2° | 140.0° |
C08 | C07 | C06 | H5 | 89.0° | 103.6° |
C08 | C07 | C06 | H6 | 33.4° | 17.8° |
C07 | C08 | H8 | H9 | 119.6° | 123.0° |
C07 | C08 | C09 | H10 | 143.4° | 152.9° |
C08 | C09 | C18 | N17 | 107.3° | 100.6° |
C09 | C08 | C07 | C06 | 114.3° | 114.1° |
C09 | C08 | C07 | C11 | 2.7° | 5.0° |
C08 | C09 | C18 | O10 | 110.6° | 110.4° |
C08 | C09 | C18 | H10 | 128.4° | 124.2° |
C08 | C09 | O10 | H10 | 120.4° | 122.8° |
C08 | C09 | C18 | C13 | 71.3° | 79.3° |
C08 | C09 | O10 | C11 | 40.5° | 44.6° |
C09 | C08 | C07 | H7 | 126.2° | 118.6° |
C09 | C08 | H8 | H9 | 119.6° | 123.0° |
N17 | C16 | C15 | H13 | 180.0° | 180.0° |
C16 | N17 | C18 | C09 | 179.6° | 179.6° |
C16 | N17 | C18 | C13 | 1.0° | 0.3° |
N17 | C16 | C15 | N14 | 0.2° | 0.2° |
N17 | C16 | C15 | H1 | 179.8° | 179.7° |
C18 | N17 | C16 | C15 | 0.6° | 0.0° |
N17 | C18 | C09 | C13 | 178.6° | 179.8° |
N17 | C18 | C09 | O10 | 142.0° | 149.0° |
N17 | C18 | C13 | N14 | 0.9° | 0.3° |
N17 | C18 | C13 | C12 | 179.1° | 179.2° |
N17 | C18 | C09 | H10 | 21.0° | 23.6° |
C18 | N17 | C16 | H13 | 179.4° | 180.0° |
C16 | C15 | N14 | H1 | 180.0° | 179.9° |
C16 | C15 | N14 | C13 | 0.2° | 0.1° |
C06 | C07 | C11 | H7 | 115.3° | 122.7° |
C07 | C06 | N05 | H5 | 118.7° | 119.3° |
C07 | C06 | N05 | H6 | 118.8° | 119.4° |
C07 | C06 | N05 | C03 | 160.7° | 161.7° |
C07 | C06 | N05 | C19 | 23.0° | 18.4° |
C06 | C07 | C11 | O10 | 89.2° | 91.9° |
C06 | C07 | C11 | C12 | 154.6° | 149.1° |
C06 | C07 | C11 | C19 | 27.7° | 26.5° |
C07 | C06 | H5 | H6 | 123.5° | 121.4° |
C06 | C07 | C08 | H8 | 5.8° | 4.4° |
C06 | C07 | C08 | H9 | 125.5° | 127.5° |
C11 | C07 | C06 | N05 | 31.2° | 27.7° |
C07 | C11 | O10 | C09 | 41.0° | 41.6° |
C07 | C11 | C12 | C13 | 66.1° | 71.4° |
C07 | C11 | C19 | N05 | 13.9° | 16.4° |
C07 | C11 | O10 | C12 | 120.9° | 120.0° |
C07 | C11 | O10 | C19 | 115.1° | 114.0° |
C07 | C11 | C12 | C19 | 124.9° | 118.1° |
C11 | C07 | C06 | H5 | 150.0° | 146.9° |
C11 | C07 | C06 | H6 | 87.6° | 91.7° |
C11 | C07 | C08 | H8 | 122.9° | 113.5° |
C11 | C07 | C08 | H9 | 117.4° | 123.4° |
C07 | C11 | C12 | H11 | 173.6° | 168.6° |
C07 | C11 | C12 | H12 | 54.2° | 48.6° |
C07 | C11 | C19 | H14 | 105.1° | 136.0° |
C07 | C11 | C19 | H15 | 132.9° | 103.2° |
C06 | N05 | C03 | O04 | 5.4° | 180.0° |
C06 | N05 | C03 | C19 | 176.0° | 179.9° |
C06 | N05 | C19 | C11 | 7.5° | 1.1° |
C06 | N05 | C03 | O02 | 175.2° | 0.0° |
N05 | C06 | H5 | H6 | 123.5° | 121.3° |
N05 | C06 | C07 | H7 | 85.9° | 95.3° |
C06 | N05 | C19 | H14 | 126.5° | 118.5° |
C06 | N05 | C19 | H15 | 111.5° | 120.7° |
C18 | C09 | O10 | H10 | 122.9° | 125.0° |
C09 | C18 | C13 | N14 | 179.6° | 179.5° |
C09 | C18 | C13 | C12 | 0.5° | 1.0° |
C18 | C09 | O10 | C11 | 76.2° | 67.6° |
C18 | C09 | C08 | H8 | 151.2° | 158.6° |
C18 | C09 | C08 | H9 | 31.5° | 35.5° |
O10 | C09 | C18 | C13 | 39.3° | 31.1° |
C09 | O10 | C11 | C12 | 79.9° | 78.3° |
C09 | O10 | C11 | C19 | 156.1° | 155.6° |
O10 | C09 | C08 | H8 | 94.5° | 88.8° |
O10 | C09 | C08 | H9 | 145.8° | 148.1° |
C18 | C13 | N14 | C15 | 0.5° | 0.2° |
C18 | C13 | N14 | C12 | 179.9° | 179.5° |
C18 | C13 | C12 | C11 | 2.3° | 7.1° |
C13 | C18 | C09 | H10 | 160.3° | 156.6° |
C18 | C13 | C12 | H11 | 118.0° | 113.0° |
C18 | C13 | C12 | H12 | 122.6° | 127.1° |
C15 | N14 | C13 | C12 | 179.5° | 179.4° |
N14 | C15 | C16 | H13 | 179.8° | 179.9° |
N14 | C13 | C12 | C11 | 177.7° | 173.4° |
C13 | N14 | C15 | H1 | 179.8° | 179.8° |
N14 | C13 | C12 | H11 | 61.9° | 66.6° |
N14 | C13 | C12 | H12 | 57.4° | 53.4° |
C13 | C12 | C11 | O10 | 46.0° | 45.2° |
C13 | C12 | C11 | H11 | 120.3° | 120.1° |
C13 | C12 | C11 | H12 | 120.3° | 120.0° |
C13 | C12 | C11 | C19 | 169.0° | 170.6° |
C13 | C12 | H11 | H12 | 119.0° | 120.0° |
O04 | C03 | N05 | O02 | 179.4° | 180.0° |
O04 | C03 | N05 | C19 | 170.6° | 0.1° |
O04 | C03 | O02 | C01 | 3.1° | 0.0° |
C03 | N05 | C19 | C11 | 175.9° | 178.9° |
N05 | C03 | O02 | C01 | 177.6° | 180.0° |
C03 | N05 | C06 | H5 | 41.9° | 42.3° |
C03 | N05 | C06 | H6 | 80.5° | 79.0° |
C03 | N05 | C19 | H14 | 56.9° | 61.5° |
C03 | N05 | C19 | H15 | 65.1° | 59.4° |
N05 | C19 | C11 | O10 | 96.4° | 97.8° |
N05 | C19 | C11 | C12 | 142.1° | 137.8° |
N05 | C19 | C11 | H14 | 119.0° | 119.6° |
N05 | C19 | C11 | H15 | 119.0° | 119.6° |
C19 | N05 | C03 | O02 | 8.7° | 179.9° |
C19 | N05 | C06 | H5 | 141.7° | 137.7° |
C19 | N05 | C06 | H6 | 95.8° | 101.0° |
N05 | C19 | H14 | H15 | 122.9° | 120.9° |
O10 | C11 | C12 | C19 | 123.1° | 125.4° |
O10 | C11 | C07 | H7 | 155.5° | 145.4° |
C11 | O10 | C09 | H10 | 160.9° | 167.4° |
O10 | C11 | C12 | H11 | 74.4° | 74.9° |
O10 | C11 | C12 | H12 | 166.3° | 165.1° |
O10 | C11 | C19 | H14 | 144.6° | 21.8° |
O10 | C11 | C19 | H15 | 22.5° | 142.6° |
C12 | C11 | C07 | H7 | 39.3° | 26.4° |
C11 | C12 | H11 | H12 | 119.0° | 120.0° |
C12 | C11 | C19 | H14 | 23.1° | 102.5° |
C12 | C11 | C19 | H15 | 98.9° | 18.2° |
C19 | C11 | C07 | H7 | 87.6° | 96.2° |
C19 | C11 | C12 | H11 | 48.7° | 50.5° |
C19 | C11 | C12 | H12 | 70.6° | 69.5° |
C11 | C19 | H14 | H15 | 123.0° | 120.8° |
C03 | O02 | C01 | H2 | 180.0° | 60.0° |
C03 | O02 | C01 | H3 | 60.0° | 180.0° |
C03 | O02 | C01 | H4 | 60.0° | 60.0° |
O02 | C01 | H2 | H3 | 120.0° | 120.0° |
O02 | C01 | H2 | H4 | 120.0° | 120.0° |
O02 | C01 | H3 | H4 | 120.0° | 120.0° |
H1 | C15 | C16 | H13 | 0.2° | 0.2° |
H2 | C01 | H3 | H4 | 120.0° | 120.0° |
H5 | C06 | C07 | H7 | 32.8° | 24.0° |
H6 | C06 | C07 | H7 | 155.3° | 145.4° |
H7 | C07 | C08 | H8 | 113.7° | 122.9° |
H7 | C07 | C08 | H9 | 6.1° | 0.2° |
H8 | C08 | C09 | H10 | 23.2° | 34.4° |
H9 | C08 | C09 | H10 | 96.5° | 88.6° |