OVY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O09 | N02 | sing | 1.42Å | 1.45Å | |
N02 | C10 | doub | 1.29Å | 1.28Å | |
C02 | C01 | sing | 1.51Å | 1.54Å | |
O08 | C11 | doub | 1.21Å | 1.23Å | |
C10 | C11 | sing | 1.47Å | 1.53Å | |
C10 | C09 | sing | 1.51Å | 1.51Å | |
O01 | C01 | doub | 1.21Å | 1.26Å | |
C01 | N01 | sing | 1.35Å | 1.36Å | |
C11 | O07 | sing | 1.35Å | 1.27Å | |
C09 | C08 | sing | 1.53Å | 1.53Å | |
N01 | C03 | sing | 1.47Å | 1.47Å | |
O06 | C08 | sing | 1.43Å | 1.42Å | |
C08 | C03 | sing | 1.53Å | 1.55Å | |
C03 | C04 | sing | 1.53Å | 1.55Å | |
C04 | C05 | sing | 1.53Å | 1.54Å | |
C04 | O02 | sing | 1.43Å | 1.44Å | |
O03 | C05 | sing | 1.43Å | 1.44Å | |
C05 | C06 | sing | 1.53Å | 1.53Å | |
O04 | C06 | sing | 1.43Å | 1.44Å | |
C06 | C07 | sing | 1.53Å | 1.52Å | |
C07 | O05 | sing | 1.43Å | 1.45Å | |
C02 | H03 | sing | 1.09Å | 1.10Å | |
C02 | H01 | sing | 1.09Å | 1.10Å | |
C02 | H02 | sing | 1.09Å | 1.10Å | |
C03 | H05 | sing | 1.09Å | 1.10Å | |
C04 | H06 | sing | 1.09Å | 1.10Å | |
C05 | H08 | sing | 1.09Å | 1.10Å | |
C06 | H10 | sing | 1.09Å | 1.10Å | |
C07 | H12 | sing | 1.09Å | 1.10Å | |
C07 | H13 | sing | 1.09Å | 1.10Å | |
C08 | H15 | sing | 1.09Å | 1.10Å | |
C09 | H18 | sing | 1.09Å | 1.10Å | |
C09 | H17 | sing | 1.09Å | 1.10Å | |
N01 | H04 | sing | 0.97Å | 1.00Å | |
O02 | H07 | sing | 0.97Å | 0.95Å | |
O03 | H09 | sing | 0.97Å | 0.95Å | |
O04 | H11 | sing | 0.97Å | 0.95Å | |
O05 | H14 | sing | 0.97Å | 0.95Å | |
O06 | H16 | sing | 0.97Å | 0.95Å | |
O07 | H1 | sing | 0.97Å | 0.95Å | |
O09 | H19 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O09 | N02 | C10 | 116.8° | 120.0° |
N02 | O09 | H19 | 109.5° | 114.1° |
N02 | C10 | C11 | 115.6° | 120.0° |
N02 | C10 | C09 | 124.0° | 119.9° |
C02 | C01 | O01 | 121.5° | 120.0° |
C02 | C01 | N01 | 116.9° | 120.0° |
C01 | C02 | H03 | 109.5° | 109.5° |
C01 | C02 | H01 | 109.5° | 109.5° |
C01 | C02 | H02 | 109.5° | 109.4° |
O08 | C11 | C10 | 117.8° | 120.0° |
O08 | C11 | O07 | 128.2° | 120.0° |
C11 | C10 | C09 | 120.3° | 120.0° |
C10 | C11 | O07 | 114.0° | 120.0° |
C10 | C09 | C08 | 120.9° | 109.4° |
C10 | C09 | H18 | 106.6° | 109.4° |
C10 | C09 | H17 | 106.5° | 109.5° |
O01 | C01 | N01 | 121.6° | 120.0° |
C01 | N01 | C03 | 129.3° | 120.0° |
C01 | N01 | H04 | 115.4° | 120.0° |
C11 | O07 | H1 | 109.5° | 117.0° |
C09 | C08 | O06 | 109.4° | 109.5° |
C09 | C08 | C03 | 110.7° | 109.5° |
C09 | C08 | H15 | 109.1° | 109.5° |
C08 | C09 | H18 | 106.5° | 109.5° |
C08 | C09 | H17 | 106.5° | 109.5° |
N01 | C03 | C08 | 107.6° | 109.5° |
N01 | C03 | C04 | 111.2° | 109.5° |
N01 | C03 | H05 | 109.7° | 109.4° |
C03 | N01 | H04 | 115.3° | 120.0° |
O06 | C08 | C03 | 108.3° | 109.4° |
O06 | C08 | H15 | 110.5° | 109.5° |
C08 | O06 | H16 | 109.5° | 114.0° |
C08 | C03 | C04 | 111.0° | 109.5° |
C08 | C03 | H05 | 108.7° | 109.5° |
C03 | C08 | H15 | 108.9° | 109.5° |
C03 | C04 | C05 | 111.9° | 109.5° |
C03 | C04 | O02 | 111.8° | 109.5° |
C04 | C03 | H05 | 108.6° | 109.4° |
C03 | C04 | H06 | 108.2° | 109.4° |
C05 | C04 | O02 | 106.7° | 109.5° |
C04 | C05 | O03 | 108.3° | 109.5° |
C04 | C05 | C06 | 122.5° | 109.5° |
C05 | C04 | H06 | 108.4° | 109.4° |
C04 | C05 | H08 | 106.1° | 109.5° |
O02 | C04 | H06 | 109.7° | 109.5° |
C04 | O02 | H07 | 109.5° | 114.0° |
O03 | C05 | C06 | 105.7° | 109.5° |
O03 | C05 | H08 | 107.2° | 109.4° |
C05 | O03 | H09 | 109.5° | 114.0° |
C05 | C06 | O04 | 102.4° | 109.5° |
C05 | C06 | C07 | 109.5° | 109.5° |
C06 | C05 | H08 | 106.2° | 109.5° |
C05 | C06 | H10 | 110.5° | 109.5° |
O04 | C06 | C07 | 111.9° | 109.5° |
O04 | C06 | H10 | 111.8° | 109.5° |
C06 | O04 | H11 | 109.5° | 114.0° |
C06 | C07 | O05 | 108.3° | 109.5° |
C07 | C06 | H10 | 110.6° | 109.5° |
C06 | C07 | H12 | 109.8° | 109.5° |
C06 | C07 | H13 | 109.7° | 109.4° |
O05 | C07 | H12 | 109.8° | 109.4° |
O05 | C07 | H13 | 109.8° | 109.5° |
C07 | O05 | H14 | 109.5° | 114.0° |
H03 | C02 | H01 | 109.5° | 109.5° |
H03 | C02 | H02 | 109.5° | 109.4° |
H01 | C02 | H02 | 109.4° | 109.5° |
H12 | C07 | H13 | 109.5° | 109.5° |
H18 | C09 | H17 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O09 | N02 | C10 | C11 | 179.2° | 175.0° |
O09 | N02 | C10 | C09 | 1.6° | 5.0° |
N02 | C10 | C11 | O08 | 25.1° | 180.0° |
N02 | C10 | C11 | C09 | 177.7° | 180.0° |
N02 | C10 | C11 | O07 | 156.2° | 0.0° |
N02 | C10 | C09 | C08 | 102.7° | 85.3° |
N02 | C10 | C09 | H18 | 135.7° | 154.8° |
N02 | C10 | C09 | H17 | 18.8° | 34.7° |
C10 | N02 | O09 | H19 | 180.0° | 180.0° |
C02 | C01 | O01 | N01 | 179.9° | 179.8° |
C02 | C01 | N01 | C03 | 180.0° | 175.0° |
C01 | C02 | H03 | H01 | 120.0° | 120.1° |
C01 | C02 | H03 | H02 | 120.0° | 120.0° |
C01 | C02 | H01 | H02 | 120.0° | 120.0° |
C02 | C01 | N01 | H04 | 0.0° | 5.1° |
O08 | C11 | C10 | O07 | 178.7° | 180.0° |
O08 | C11 | C10 | C09 | 152.6° | 0.0° |
O08 | C11 | O07 | H1 | 0.0° | 0.0° |
C11 | C10 | C09 | C08 | 79.7° | 94.8° |
C11 | C10 | C09 | H18 | 41.9° | 25.2° |
C11 | C10 | C09 | H17 | 158.7° | 145.3° |
C10 | C11 | O07 | H1 | 178.6° | 180.0° |
C09 | C10 | C11 | O07 | 26.1° | 180.0° |
C10 | C09 | C08 | H18 | 121.6° | 119.9° |
C10 | C09 | C08 | H17 | 121.6° | 120.0° |
C10 | C09 | C08 | O06 | 77.7° | 64.3° |
C10 | C09 | C08 | C03 | 163.0° | 175.8° |
C10 | C09 | C08 | H15 | 43.3° | 55.8° |
C10 | C09 | H18 | H17 | 114.9° | 120.0° |
O01 | C01 | N01 | C03 | 0.2° | 4.8° |
O01 | C01 | C02 | H03 | 0.0° | 90.3° |
O01 | C01 | C02 | H01 | 120.0° | 29.8° |
O01 | C01 | C02 | H02 | 120.0° | 149.8° |
O01 | C01 | N01 | H04 | 179.8° | 175.2° |
C01 | N01 | C03 | H04 | 180.0° | 179.9° |
C01 | N01 | C03 | C08 | 109.8° | 114.8° |
C01 | N01 | C03 | C04 | 128.4° | 125.1° |
N01 | C01 | C02 | H03 | 179.9° | 90.0° |
N01 | C01 | C02 | H01 | 59.9° | 150.0° |
N01 | C01 | C02 | H02 | 60.1° | 30.0° |
C01 | N01 | C03 | H05 | 8.3° | 5.1° |
C09 | C08 | C03 | N01 | 61.2° | 58.6° |
C09 | C08 | O06 | C03 | 120.7° | 119.9° |
C09 | C08 | O06 | H15 | 120.1° | 120.1° |
C09 | C08 | C03 | H15 | 119.9° | 120.0° |
C09 | C08 | C03 | C04 | 176.9° | 178.6° |
C09 | C08 | C03 | H05 | 57.5° | 61.4° |
C08 | C09 | H18 | H17 | 114.8° | 120.1° |
C09 | C08 | O06 | H16 | 180.0° | 54.8° |
N01 | C03 | C08 | O06 | 58.7° | 61.4° |
N01 | C03 | C08 | C04 | 121.9° | 120.1° |
N01 | C03 | C08 | H05 | 118.7° | 119.9° |
N01 | C03 | C04 | H05 | 120.8° | 120.0° |
N01 | C03 | C04 | C05 | 55.1° | 60.0° |
N01 | C03 | C04 | O02 | 174.8° | 180.0° |
N01 | C03 | C04 | H06 | 64.3° | 60.0° |
N01 | C03 | C08 | H15 | 178.9° | 178.6° |
O06 | C08 | C03 | H15 | 120.2° | 120.0° |
O06 | C08 | C03 | C04 | 63.2° | 58.7° |
O06 | C08 | C03 | H05 | 177.4° | 178.6° |
O06 | C08 | C09 | H18 | 160.7° | 55.6° |
O06 | C08 | C09 | H17 | 43.9° | 175.7° |
C08 | C03 | C04 | H05 | 119.5° | 120.0° |
C08 | C03 | C04 | C05 | 174.8° | 180.0° |
C08 | C03 | C04 | O02 | 65.5° | 59.9° |
C08 | C03 | C04 | H06 | 55.5° | 60.1° |
C03 | C08 | C09 | H18 | 41.4° | 64.3° |
C03 | C08 | C09 | H17 | 75.4° | 55.8° |
C08 | C03 | N01 | H04 | 70.2° | 65.2° |
C03 | C08 | O06 | H16 | 59.3° | 65.1° |
C03 | C04 | C05 | O02 | 122.6° | 120.0° |
C03 | C04 | C05 | H06 | 119.3° | 119.9° |
C03 | C04 | O02 | H06 | 120.1° | 120.0° |
C03 | C04 | C05 | O03 | 60.9° | 55.0° |
C03 | C04 | C05 | C06 | 175.8° | 175.0° |
C03 | C04 | C05 | H08 | 53.9° | 64.9° |
C04 | C03 | C08 | H15 | 57.0° | 61.3° |
C04 | C03 | N01 | H04 | 51.5° | 54.8° |
C03 | C04 | O02 | H07 | 180.0° | 60.1° |
C05 | C04 | O02 | H06 | 117.2° | 120.0° |
C04 | C05 | O03 | C06 | 132.9° | 120.0° |
C04 | C05 | O03 | H08 | 114.1° | 120.0° |
C04 | C05 | C06 | H08 | 121.8° | 120.1° |
C04 | C05 | C06 | O04 | 72.6° | 60.0° |
C04 | C05 | C06 | C07 | 168.6° | 180.0° |
C05 | C04 | C03 | H05 | 65.7° | 60.0° |
C04 | C05 | C06 | H10 | 46.6° | 60.0° |
C05 | C04 | O02 | H07 | 57.3° | 60.0° |
C04 | C05 | O03 | H09 | 180.0° | 60.0° |
O02 | C04 | C05 | O03 | 61.7° | 65.0° |
O02 | C04 | C05 | C06 | 61.6° | 55.0° |
O02 | C04 | C03 | H05 | 54.0° | 60.0° |
O02 | C04 | C05 | H08 | 176.5° | 175.0° |
O03 | C05 | C06 | H08 | 113.7° | 119.9° |
O03 | C05 | C06 | O04 | 162.9° | 180.0° |
O03 | C05 | C06 | C07 | 44.1° | 59.9° |
O03 | C05 | C04 | H06 | 179.8° | 174.9° |
O03 | C05 | C06 | H10 | 77.9° | 60.0° |
C05 | C06 | O04 | C07 | 117.1° | 120.0° |
C05 | C06 | O04 | H10 | 118.2° | 120.0° |
C05 | C06 | C07 | H10 | 121.9° | 120.0° |
C05 | C06 | C07 | O05 | 145.4° | 175.0° |
C06 | C05 | C04 | H06 | 56.5° | 65.0° |
C05 | C06 | C07 | H12 | 94.8° | 55.0° |
C05 | C06 | C07 | H13 | 25.6° | 65.0° |
C06 | C05 | O03 | H09 | 47.1° | 60.0° |
C05 | C06 | O04 | H11 | 180.0° | 60.0° |
O04 | C06 | C07 | H10 | 125.3° | 120.0° |
O04 | C06 | C07 | O05 | 32.6° | 65.0° |
O04 | C06 | C05 | H08 | 49.2° | 60.0° |
O04 | C06 | C07 | H12 | 152.4° | 175.0° |
O04 | C06 | C07 | H13 | 87.2° | 55.0° |
C06 | C07 | O05 | H12 | 119.8° | 120.0° |
C06 | C07 | O05 | H13 | 119.8° | 120.0° |
C07 | C06 | C05 | H08 | 69.6° | 60.0° |
C06 | C07 | H12 | H13 | 120.5° | 120.0° |
C07 | C06 | O04 | H11 | 62.9° | 60.0° |
C06 | C07 | O05 | H14 | 180.0° | 180.0° |
O05 | C07 | C06 | H10 | 92.7° | 55.0° |
O05 | C07 | H12 | H13 | 120.6° | 120.1° |
H03 | C02 | H01 | H02 | 120.0° | 120.0° |
H05 | C03 | C04 | H06 | 175.0° | 180.0° |
H05 | C03 | C08 | H15 | 62.4° | 58.6° |
H05 | C03 | N01 | H04 | 171.7° | 174.8° |
H06 | C04 | C05 | H08 | 65.4° | 55.0° |
H06 | C04 | O02 | H07 | 59.9° | 180.0° |
H08 | C05 | C06 | H10 | 168.4° | 180.0° |
H08 | C05 | O03 | H09 | 65.9° | 180.0° |
H10 | C06 | C07 | H12 | 27.1° | 65.0° |
H10 | C06 | C07 | H13 | 147.5° | 175.0° |
H10 | C06 | O04 | H11 | 61.8° | 180.0° |
H12 | C07 | O05 | H14 | 60.2° | 60.0° |
H13 | C07 | O05 | H14 | 60.2° | 60.0° |
H15 | C08 | C09 | H18 | 78.3° | 175.7° |
H15 | C08 | C09 | H17 | 164.9° | 64.2° |
H15 | C08 | O06 | H16 | 59.9° | 174.9° |