N7G
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C08 | C07 | sing | 1.53Å | 1.53Å | |
C10 | O11 | sing | 1.43Å | 1.40Å | |
C10 | C12 | sing | 1.51Å | 1.53Å | |
C10 | C07 | sing | 1.53Å | 1.57Å | |
O13 | C12 | doub | 1.21Å | 1.22Å | |
C06 | C07 | sing | 1.53Å | 1.55Å | |
C12 | N14 | sing | 1.35Å | 1.35Å | |
C07 | C09 | sing | 1.53Å | 1.56Å | |
N14 | C15 | sing | 1.47Å | 1.47Å | |
C15 | C16 | sing | 1.53Å | 1.53Å | |
O18 | C17 | doub | 1.21Å | 1.23Å | |
C16 | C17 | sing | 1.51Å | 1.52Å | |
C17 | N19 | sing | 1.35Å | 1.33Å | |
N19 | C20 | sing | 1.46Å | 1.43Å | |
C20 | C21 | sing | 1.53Å | 1.51Å | |
C21 | C22 | sing | 1.53Å | 1.54Å | |
C22 | C23 | sing | 1.53Å | 1.52Å | |
C23 | C24 | sing | 1.53Å | 1.52Å | |
C24 | O25 | sing | 1.43Å | 1.45Å | |
O25 | C26 | sing | 1.43Å | 1.45Å | |
C06 | H1 | sing | 1.09Å | 1.10Å | |
C06 | H2 | sing | 1.09Å | 1.10Å | |
C06 | H3 | sing | 1.09Å | 1.10Å | |
C08 | H4 | sing | 1.09Å | 1.10Å | |
C08 | H5 | sing | 1.09Å | 1.10Å | |
C08 | H6 | sing | 1.09Å | 1.10Å | |
C09 | H7 | sing | 1.09Å | 1.10Å | |
C09 | H8 | sing | 1.09Å | 1.10Å | |
C09 | H9 | sing | 1.09Å | 1.10Å | |
C10 | H10 | sing | 1.09Å | 1.10Å | |
O11 | H11 | sing | 0.97Å | 0.95Å | |
N14 | H12 | sing | 0.97Å | 1.00Å | |
C15 | H13 | sing | 1.09Å | 1.10Å | |
C15 | H14 | sing | 1.09Å | 1.10Å | |
C16 | H15 | sing | 1.09Å | 1.10Å | |
C16 | H16 | sing | 1.09Å | 1.10Å | |
N19 | H17 | sing | 0.97Å | 1.00Å | |
C20 | H18 | sing | 1.09Å | 1.10Å | |
C20 | H19 | sing | 1.09Å | 1.10Å | |
C21 | H20 | sing | 1.09Å | 1.10Å | |
C21 | H21 | sing | 1.09Å | 1.10Å | |
C22 | H22 | sing | 1.09Å | 1.10Å | |
C22 | H23 | sing | 1.09Å | 1.10Å | |
C23 | H24 | sing | 1.09Å | 1.10Å | |
C23 | H25 | sing | 1.09Å | 1.10Å | |
C24 | H26 | sing | 1.09Å | 1.10Å | |
C24 | H27 | sing | 1.09Å | 1.10Å | |
C26 | H28 | sing | 1.09Å | 1.10Å | |
C26 | H29 | sing | 1.09Å | 1.10Å | |
C26 | H30 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C08 | C07 | C10 | 108.7° | 109.5° |
C08 | C07 | C06 | 108.8° | 109.5° |
C08 | C07 | C09 | 111.7° | 109.4° |
C07 | C08 | H4 | 109.5° | 109.5° |
C07 | C08 | H5 | 109.5° | 109.4° |
C07 | C08 | H6 | 109.5° | 109.5° |
O11 | C10 | C12 | 106.8° | 109.4° |
O11 | C10 | C07 | 109.0° | 109.5° |
O11 | C10 | H10 | 110.4° | 109.4° |
C10 | O11 | H11 | 109.5° | 113.9° |
C12 | C10 | C07 | 113.9° | 109.5° |
C10 | C12 | O13 | 121.6° | 120.1° |
C10 | C12 | N14 | 115.5° | 120.0° |
C12 | C10 | H10 | 108.6° | 109.4° |
C10 | C07 | C06 | 108.8° | 109.5° |
C10 | C07 | C09 | 111.8° | 109.5° |
C07 | C10 | H10 | 108.2° | 109.5° |
O13 | C12 | N14 | 122.9° | 120.0° |
C06 | C07 | C09 | 107.0° | 109.5° |
C07 | C06 | H1 | 109.5° | 109.5° |
C07 | C06 | H2 | 109.5° | 109.5° |
C07 | C06 | H3 | 109.4° | 109.5° |
C12 | N14 | C15 | 122.3° | 120.0° |
C12 | N14 | H12 | 118.8° | 120.0° |
C07 | C09 | H7 | 109.5° | 109.4° |
C07 | C09 | H8 | 109.5° | 109.5° |
C07 | C09 | H9 | 109.5° | 109.5° |
N14 | C15 | C16 | 111.0° | 109.5° |
C15 | N14 | H12 | 118.9° | 120.0° |
N14 | C15 | H13 | 109.1° | 109.5° |
N14 | C15 | H14 | 109.1° | 109.4° |
C15 | C16 | C17 | 110.3° | 109.5° |
C16 | C15 | H13 | 109.1° | 109.5° |
C16 | C15 | H14 | 109.1° | 109.5° |
C15 | C16 | H15 | 109.2° | 109.5° |
C15 | C16 | H16 | 109.3° | 109.5° |
O18 | C17 | C16 | 119.2° | 120.0° |
O18 | C17 | N19 | 123.6° | 120.0° |
C16 | C17 | N19 | 117.1° | 120.0° |
C17 | C16 | H15 | 109.3° | 109.4° |
C17 | C16 | H16 | 109.3° | 109.5° |
C17 | N19 | C20 | 119.3° | 120.1° |
C17 | N19 | H17 | 120.4° | 120.0° |
N19 | C20 | C21 | 112.3° | 109.5° |
C20 | N19 | H17 | 120.4° | 119.9° |
N19 | C20 | H18 | 108.7° | 109.5° |
N19 | C20 | H19 | 108.8° | 109.4° |
C20 | C21 | C22 | 112.9° | 109.5° |
C21 | C20 | H18 | 108.8° | 109.5° |
C21 | C20 | H19 | 108.8° | 109.5° |
C20 | C21 | H20 | 108.6° | 109.5° |
C20 | C21 | H21 | 108.6° | 109.5° |
C21 | C22 | C23 | 104.1° | 109.5° |
C22 | C21 | H20 | 108.6° | 109.5° |
C22 | C21 | H21 | 108.6° | 109.4° |
C21 | C22 | H22 | 110.8° | 109.5° |
C21 | C22 | H23 | 110.8° | 109.4° |
C22 | C23 | C24 | 120.9° | 109.5° |
C23 | C22 | H22 | 110.8° | 109.5° |
C23 | C22 | H23 | 110.8° | 109.5° |
C22 | C23 | H24 | 106.5° | 109.5° |
C22 | C23 | H25 | 106.5° | 109.5° |
C23 | C24 | O25 | 114.6° | 109.5° |
C24 | C23 | H24 | 106.5° | 109.5° |
C24 | C23 | H25 | 106.6° | 109.4° |
C23 | C24 | H26 | 108.2° | 109.5° |
C23 | C24 | H27 | 108.2° | 109.4° |
C24 | O25 | C26 | 113.1° | 114.0° |
O25 | C24 | H26 | 108.2° | 109.5° |
O25 | C24 | H27 | 108.2° | 109.5° |
O25 | C26 | H28 | 109.5° | 109.4° |
O25 | C26 | H29 | 109.5° | 109.5° |
O25 | C26 | H30 | 109.5° | 109.5° |
H1 | C06 | H2 | 109.4° | 109.5° |
H1 | C06 | H3 | 109.5° | 109.5° |
H2 | C06 | H3 | 109.5° | 109.5° |
H4 | C08 | H5 | 109.5° | 109.5° |
H4 | C08 | H6 | 109.5° | 109.5° |
H5 | C08 | H6 | 109.4° | 109.4° |
H7 | C09 | H8 | 109.5° | 109.5° |
H7 | C09 | H9 | 109.5° | 109.4° |
H8 | C09 | H9 | 109.4° | 109.6° |
H13 | C15 | H14 | 109.4° | 109.5° |
H15 | C16 | H16 | 109.5° | 109.5° |
H18 | C20 | H19 | 109.4° | 109.4° |
H20 | C21 | H21 | 109.5° | 109.5° |
H22 | C22 | H23 | 109.4° | 109.5° |
H24 | C23 | H25 | 109.4° | 109.4° |
H26 | C24 | H27 | 109.5° | 109.4° |
H28 | C26 | H29 | 109.5° | 109.5° |
H28 | C26 | H30 | 109.4° | 109.4° |
H29 | C26 | H30 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C08 | C07 | C10 | O11 | 168.8° | 65.4° |
C08 | C07 | C10 | C12 | 72.0° | 54.6° |
C08 | C07 | C10 | C06 | 118.3° | 120.0° |
C08 | C07 | C10 | C09 | 123.8° | 120.0° |
C08 | C07 | C06 | C09 | 120.8° | 120.0° |
C08 | C07 | C06 | H1 | 180.0° | 59.9° |
C08 | C07 | C06 | H2 | 60.0° | 60.0° |
C08 | C07 | C06 | H3 | 60.0° | 180.0° |
C07 | C08 | H4 | H5 | 120.0° | 120.0° |
C07 | C08 | H4 | H6 | 120.0° | 120.0° |
C07 | C08 | H5 | H6 | 120.0° | 119.9° |
C08 | C07 | C09 | H7 | 180.0° | 173.0° |
C08 | C07 | C09 | H8 | 60.0° | 53.0° |
C08 | C07 | C09 | H9 | 60.0° | 67.1° |
C08 | C07 | C10 | H10 | 48.7° | 174.6° |
O11 | C10 | C12 | C07 | 120.4° | 120.0° |
O11 | C10 | C12 | H10 | 119.0° | 119.9° |
O11 | C10 | C07 | H10 | 120.1° | 120.0° |
O11 | C10 | C12 | O13 | 169.0° | 13.9° |
O11 | C10 | C07 | C06 | 50.5° | 54.7° |
O11 | C10 | C12 | N14 | 11.3° | 166.2° |
O11 | C10 | C07 | C09 | 67.4° | 174.6° |
C12 | C10 | C07 | H10 | 120.8° | 120.0° |
C10 | C12 | O13 | N14 | 179.7° | 179.9° |
C12 | C10 | C07 | C06 | 169.6° | 174.7° |
C12 | C10 | C07 | C09 | 51.8° | 65.3° |
C10 | C12 | N14 | C15 | 177.6° | 175.1° |
C12 | C10 | O11 | H11 | 180.0° | 60.0° |
C10 | C12 | N14 | H12 | 2.4° | 4.8° |
C07 | C10 | C12 | O13 | 70.6° | 106.1° |
C10 | C07 | C06 | C09 | 120.9° | 120.0° |
C07 | C10 | C12 | N14 | 109.1° | 73.8° |
C10 | C07 | C06 | H1 | 61.7° | 180.0° |
C10 | C07 | C06 | H2 | 58.3° | 60.0° |
C10 | C07 | C06 | H3 | 178.3° | 60.0° |
C10 | C07 | C08 | H4 | 180.0° | 180.0° |
C10 | C07 | C08 | H5 | 60.0° | 60.0° |
C10 | C07 | C08 | H6 | 60.0° | 59.9° |
C10 | C07 | C09 | H7 | 57.9° | 52.9° |
C10 | C07 | C09 | H8 | 177.9° | 67.1° |
C10 | C07 | C09 | H9 | 62.1° | 172.9° |
C07 | C10 | O11 | H11 | 56.5° | 60.0° |
O13 | C12 | N14 | C15 | 2.0° | 5.0° |
O13 | C12 | C10 | H10 | 50.0° | 133.8° |
O13 | C12 | N14 | H12 | 178.0° | 175.1° |
C07 | C06 | H1 | H2 | 120.0° | 120.0° |
C07 | C06 | H1 | H3 | 120.0° | 120.0° |
C07 | C06 | H2 | H3 | 120.0° | 120.0° |
C06 | C07 | C08 | H4 | 61.7° | 60.0° |
C06 | C07 | C08 | H5 | 58.3° | 180.0° |
C06 | C07 | C08 | H6 | 178.3° | 60.1° |
C06 | C07 | C09 | H7 | 61.0° | 67.1° |
C06 | C07 | C09 | H8 | 59.0° | 173.0° |
C06 | C07 | C09 | H9 | 178.9° | 52.9° |
C06 | C07 | C10 | H10 | 69.6° | 65.3° |
C12 | N14 | C15 | H12 | 180.0° | 179.9° |
C12 | N14 | C15 | C16 | 74.6° | 179.9° |
N14 | C12 | C10 | H10 | 130.3° | 46.3° |
C12 | N14 | C15 | H13 | 45.7° | 59.9° |
C12 | N14 | C15 | H14 | 165.2° | 60.1° |
C09 | C07 | C06 | H1 | 59.2° | 60.0° |
C09 | C07 | C06 | H2 | 179.2° | 180.0° |
C09 | C07 | C06 | H3 | 60.8° | 60.0° |
C09 | C07 | C08 | H4 | 56.1° | 60.0° |
C09 | C07 | C08 | H5 | 176.2° | 60.1° |
C09 | C07 | C08 | H6 | 63.9° | 180.0° |
C07 | C09 | H7 | H8 | 120.0° | 120.0° |
C07 | C09 | H7 | H9 | 120.0° | 119.9° |
C07 | C09 | H8 | H9 | 120.0° | 120.0° |
C09 | C07 | C10 | H10 | 172.5° | 54.7° |
N14 | C15 | C16 | H13 | 120.3° | 120.0° |
N14 | C15 | C16 | H14 | 120.2° | 120.0° |
N14 | C15 | C16 | C17 | 161.9° | 180.0° |
N14 | C15 | H13 | H14 | 119.3° | 120.0° |
N14 | C15 | C16 | H15 | 78.0° | 60.0° |
N14 | C15 | C16 | H16 | 41.7° | 60.0° |
C15 | C16 | C17 | O18 | 88.4° | 0.0° |
C15 | C16 | C17 | H15 | 120.1° | 120.0° |
C15 | C16 | C17 | H16 | 120.1° | 120.1° |
C15 | C16 | C17 | N19 | 92.3° | 180.0° |
C16 | C15 | N14 | H12 | 105.4° | 0.0° |
C16 | C15 | H13 | H14 | 119.3° | 120.0° |
C15 | C16 | H15 | H16 | 119.6° | 120.1° |
O18 | C17 | C16 | N19 | 179.3° | 180.0° |
O18 | C17 | N19 | C20 | 3.1° | 0.1° |
O18 | C17 | C16 | H15 | 151.5° | 120.0° |
O18 | C17 | C16 | H16 | 31.8° | 120.1° |
O18 | C17 | N19 | H17 | 176.9° | 180.0° |
C16 | C17 | N19 | C20 | 177.6° | 180.0° |
C17 | C16 | C15 | H13 | 41.6° | 60.0° |
C17 | C16 | C15 | H14 | 77.9° | 60.0° |
C17 | C16 | H15 | H16 | 119.6° | 120.0° |
C16 | C17 | N19 | H17 | 2.4° | 0.1° |
C17 | N19 | C20 | H17 | 180.0° | 179.9° |
C17 | N19 | C20 | C21 | 175.9° | 180.0° |
N19 | C17 | C16 | H15 | 27.8° | 60.0° |
N19 | C17 | C16 | H16 | 147.6° | 60.0° |
C17 | N19 | C20 | H18 | 63.7° | 59.9° |
C17 | N19 | C20 | H19 | 55.4° | 60.0° |
N19 | C20 | C21 | H18 | 120.4° | 120.0° |
N19 | C20 | C21 | H19 | 120.4° | 120.0° |
N19 | C20 | C21 | C22 | 60.6° | 180.0° |
N19 | C20 | H18 | H19 | 118.7° | 119.9° |
N19 | C20 | C21 | H20 | 178.9° | 60.0° |
N19 | C20 | C21 | H21 | 59.9° | 60.1° |
C20 | C21 | C22 | H20 | 120.5° | 120.0° |
C20 | C21 | C22 | H21 | 120.5° | 120.0° |
C20 | C21 | C22 | C23 | 153.6° | 180.0° |
C21 | C20 | N19 | H17 | 4.1° | 0.1° |
C21 | C20 | H18 | H19 | 118.7° | 120.0° |
C20 | C21 | H20 | H21 | 118.4° | 120.0° |
C20 | C21 | C22 | H22 | 87.2° | 60.0° |
C20 | C21 | C22 | H23 | 34.4° | 60.0° |
C21 | C22 | C23 | H22 | 119.1° | 120.0° |
C21 | C22 | C23 | H23 | 119.2° | 119.9° |
C21 | C22 | C23 | C24 | 176.2° | 180.0° |
C22 | C21 | C20 | H18 | 59.8° | 60.0° |
C22 | C21 | C20 | H19 | 178.9° | 60.0° |
C22 | C21 | H20 | H21 | 118.4° | 120.0° |
C21 | C22 | H22 | H23 | 122.5° | 120.0° |
C21 | C22 | C23 | H24 | 54.6° | 59.9° |
C21 | C22 | C23 | H25 | 62.1° | 60.0° |
C22 | C23 | C24 | H24 | 121.6° | 120.1° |
C22 | C23 | C24 | H25 | 121.6° | 120.0° |
C22 | C23 | C24 | O25 | 16.7° | 180.0° |
C23 | C22 | C21 | H20 | 33.1° | 60.0° |
C23 | C22 | C21 | H21 | 85.9° | 60.0° |
C23 | C22 | H22 | H23 | 122.5° | 120.0° |
C22 | C23 | H24 | H25 | 114.8° | 120.0° |
C22 | C23 | C24 | H26 | 104.1° | 59.9° |
C22 | C23 | C24 | H27 | 137.4° | 60.0° |
C23 | C24 | O25 | H26 | 120.7° | 120.0° |
C23 | C24 | O25 | H27 | 120.7° | 120.0° |
C23 | C24 | O25 | C26 | 157.7° | 180.0° |
C24 | C23 | C22 | H22 | 64.6° | 60.0° |
C24 | C23 | C22 | H23 | 57.1° | 60.0° |
C24 | C23 | H24 | H25 | 114.8° | 119.9° |
C23 | C24 | H26 | H27 | 117.6° | 119.9° |
O25 | C24 | C23 | H24 | 138.3° | 59.9° |
O25 | C24 | C23 | H25 | 104.9° | 60.0° |
O25 | C24 | H26 | H27 | 117.7° | 120.0° |
C24 | O25 | C26 | H28 | 180.0° | 180.0° |
C24 | O25 | C26 | H29 | 60.0° | 60.0° |
C24 | O25 | C26 | H30 | 60.0° | 60.1° |
C26 | O25 | C24 | H26 | 37.0° | 60.0° |
C26 | O25 | C24 | H27 | 81.5° | 60.0° |
O25 | C26 | H28 | H29 | 120.0° | 120.0° |
O25 | C26 | H28 | H30 | 120.0° | 120.0° |
O25 | C26 | H29 | H30 | 120.0° | 120.1° |
H1 | C06 | H2 | H3 | 120.0° | 120.0° |
H4 | C08 | H5 | H6 | 120.0° | 120.0° |
H7 | C09 | H8 | H9 | 120.0° | 120.0° |
H10 | C10 | O11 | H11 | 62.2° | 179.9° |
H12 | N14 | C15 | H13 | 134.3° | 119.9° |
H12 | N14 | C15 | H14 | 14.8° | 120.0° |
H13 | C15 | C16 | H15 | 161.8° | 180.0° |
H13 | C15 | C16 | H16 | 78.5° | 60.0° |
H14 | C15 | C16 | H15 | 42.3° | 59.9° |
H14 | C15 | C16 | H16 | 162.0° | 180.0° |
H17 | N19 | C20 | H18 | 116.3° | 120.0° |
H17 | N19 | C20 | H19 | 124.6° | 120.1° |
H18 | C20 | C21 | H20 | 60.7° | 180.0° |
H18 | C20 | C21 | H21 | 179.7° | 60.0° |
H19 | C20 | C21 | H20 | 58.4° | 60.0° |
H19 | C20 | C21 | H21 | 60.6° | 179.9° |
H20 | C21 | C22 | H22 | 152.3° | 180.0° |
H20 | C21 | C22 | H23 | 86.1° | 60.0° |
H21 | C21 | C22 | H22 | 33.3° | 60.0° |
H21 | C21 | C22 | H23 | 154.9° | 180.0° |
H22 | C22 | C23 | H24 | 173.8° | 179.9° |
H22 | C22 | C23 | H25 | 57.0° | 60.0° |
H23 | C22 | C23 | H24 | 64.5° | 60.0° |
H23 | C22 | C23 | H25 | 178.7° | 180.0° |
H24 | C23 | C24 | H26 | 17.5° | 180.0° |
H24 | C23 | C24 | H27 | 101.0° | 60.1° |
H25 | C23 | C24 | H26 | 134.3° | 60.1° |
H25 | C23 | C24 | H27 | 15.8° | 180.0° |
H28 | C26 | H29 | H30 | 120.0° | 120.0° |