289
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C7 | O7 | sing | 1.43Å | 1.44Å | |
O7 | HO7 | sing | 0.97Å | 0.95Å | |
C6 | C7 | sing | 1.53Å | 1.54Å | |
C7 | H71 | sing | 1.09Å | 1.10Å | |
C7 | H72 | sing | 1.09Å | 1.10Å | |
O6 | C6 | sing | 1.43Å | 1.43Å | |
C5 | C6 | sing | 1.53Å | 1.57Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
O6 | HO6 | sing | 0.97Å | 0.95Å | |
O5 | C5 | sing | 1.43Å | 1.50Å | |
C5 | C4 | sing | 1.53Å | 1.58Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C1 | O5 | sing | 1.43Å | 1.50Å | |
O1 | C1 | sing | 1.43Å | 1.45Å | |
C1 | C2 | sing | 1.53Å | 1.58Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
O1 | HO1 | sing | 0.97Å | 0.95Å | |
C2 | O2 | sing | 1.43Å | 1.45Å | |
C2 | C3 | sing | 1.53Å | 1.56Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C3 | C4 | sing | 1.53Å | 1.56Å | |
C3 | O3 | sing | 1.43Å | 1.42Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C4 | O4 | sing | 1.43Å | 1.45Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C7 | O7 | HO7 | 109.5° | 114.0° |
O7 | C7 | C6 | 109.9° | 109.5° |
O7 | C7 | H71 | 109.4° | 109.5° |
O7 | C7 | H72 | 109.2° | 109.5° |
C6 | C7 | H71 | 109.3° | 109.5° |
C6 | C7 | H72 | 109.3° | 109.4° |
C7 | C6 | O6 | 107.9° | 109.5° |
C7 | C6 | C5 | 112.1° | 109.5° |
C7 | C6 | H6 | 108.9° | 109.5° |
H71 | C7 | H72 | 109.8° | 109.5° |
O6 | C6 | C5 | 109.9° | 109.4° |
O6 | C6 | H6 | 111.2° | 109.5° |
C6 | O6 | HO6 | 109.5° | 114.0° |
C5 | C6 | H6 | 106.9° | 109.5° |
C6 | C5 | O5 | 108.8° | 109.4° |
C6 | C5 | C4 | 111.8° | 109.5° |
C6 | C5 | H5 | 108.2° | 109.5° |
O5 | C5 | C4 | 108.8° | 109.4° |
O5 | C5 | H5 | 111.2° | 109.5° |
C5 | O5 | C1 | 113.1° | 114.1° |
C4 | C5 | H5 | 108.2° | 109.5° |
C5 | C4 | C3 | 109.5° | 109.1° |
C5 | C4 | O4 | 109.8° | 109.5° |
C5 | C4 | H4 | 109.3° | 109.5° |
O5 | C1 | O1 | 108.0° | 109.5° |
O5 | C1 | C2 | 110.0° | 109.4° |
O5 | C1 | H1 | 110.4° | 109.5° |
O1 | C1 | C2 | 110.4° | 109.5° |
O1 | C1 | H1 | 110.0° | 109.5° |
C1 | O1 | HO1 | 109.5° | 114.0° |
C2 | C1 | H1 | 108.0° | 109.5° |
C1 | C2 | O2 | 109.5° | 109.5° |
C1 | C2 | C3 | 108.8° | 109.2° |
C1 | C2 | H2 | 109.9° | 109.6° |
O2 | C2 | C3 | 109.5° | 109.5° |
O2 | C2 | H2 | 109.1° | 109.5° |
C2 | O2 | HO2 | 109.5° | 114.0° |
C3 | C2 | H2 | 109.9° | 109.6° |
C2 | C3 | C4 | 109.5° | 109.0° |
C2 | C3 | O3 | 109.0° | 109.6° |
C2 | C3 | H3 | 110.3° | 109.5° |
C4 | C3 | O3 | 110.9° | 109.6° |
C4 | C3 | H3 | 108.3° | 109.5° |
C3 | C4 | O4 | 109.7° | 109.5° |
C3 | C4 | H4 | 109.5° | 109.5° |
O3 | C3 | H3 | 108.9° | 109.6° |
C3 | O3 | HO3 | 109.5° | 114.0° |
O4 | C4 | H4 | 109.0° | 109.6° |
C4 | O4 | HO4 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O7 | C7 | C6 | H71 | 120.0° | 120.0° |
O7 | C7 | C6 | H72 | 119.8° | 120.0° |
O7 | C7 | H71 | H72 | 119.8° | 120.0° |
O7 | C7 | C6 | O6 | 81.9° | 65.0° |
O7 | C7 | C6 | C5 | 157.0° | 175.1° |
O7 | C7 | C6 | H6 | 38.9° | 55.0° |
HO7 | O7 | C7 | C6 | 93.2° | 180.0° |
HO7 | O7 | C7 | H71 | 26.7° | 60.0° |
HO7 | O7 | C7 | H72 | 146.9° | 60.0° |
C6 | C7 | H71 | H72 | 119.8° | 119.9° |
C7 | C6 | O6 | C5 | 122.5° | 120.0° |
C7 | C6 | O6 | H6 | 119.4° | 120.0° |
C7 | C6 | C5 | H6 | 119.3° | 120.0° |
C7 | C6 | O6 | HO6 | 127.8° | 60.0° |
C7 | C6 | C5 | O5 | 71.6° | 60.1° |
C7 | C6 | C5 | C4 | 48.5° | 180.0° |
C7 | C6 | C5 | H5 | 167.5° | 59.9° |
H71 | C7 | C6 | O6 | 38.1° | 55.0° |
H71 | C7 | C6 | C5 | 83.0° | 64.9° |
H71 | C7 | C6 | H6 | 159.0° | 175.0° |
H72 | C7 | C6 | O6 | 158.3° | 175.0° |
H72 | C7 | C6 | C5 | 37.2° | 55.0° |
H72 | C7 | C6 | H6 | 80.9° | 65.0° |
O6 | C6 | C5 | H6 | 120.8° | 120.0° |
O6 | C6 | C5 | O5 | 48.3° | 179.9° |
O6 | C6 | C5 | C4 | 168.4° | 60.0° |
O6 | C6 | C5 | H5 | 72.6° | 60.1° |
C5 | C6 | O6 | HO6 | 5.3° | 60.0° |
C6 | C5 | O5 | C4 | 122.0° | 119.9° |
C6 | C5 | O5 | H5 | 119.0° | 120.0° |
C6 | C5 | C4 | H5 | 119.0° | 120.1° |
C6 | C5 | O5 | C1 | 178.6° | 178.9° |
C6 | C5 | C4 | C3 | 178.3° | 177.6° |
C6 | C5 | C4 | O4 | 61.2° | 62.6° |
C6 | C5 | C4 | H4 | 58.4° | 57.6° |
H6 | C6 | O6 | HO6 | 112.8° | 180.0° |
H6 | C6 | C5 | O5 | 169.1° | 59.9° |
H6 | C6 | C5 | C4 | 70.8° | 60.0° |
H6 | C6 | C5 | H5 | 48.2° | 179.9° |
O5 | C5 | C4 | H5 | 120.9° | 120.0° |
C5 | O5 | C1 | O1 | 60.7° | 58.8° |
C5 | O5 | C1 | C2 | 59.9° | 61.1° |
C5 | O5 | C1 | H1 | 179.0° | 178.9° |
O5 | C5 | C4 | C3 | 58.2° | 57.6° |
O5 | C5 | C4 | O4 | 178.7° | 177.5° |
O5 | C5 | C4 | H4 | 61.7° | 62.3° |
C4 | C5 | O5 | C1 | 59.4° | 61.2° |
C5 | C4 | C3 | C2 | 59.2° | 57.0° |
C5 | C4 | C3 | O4 | 120.6° | 119.9° |
C5 | C4 | C3 | H4 | 119.8° | 119.9° |
C5 | C4 | C3 | O3 | 179.4° | 176.9° |
C5 | C4 | C3 | H3 | 61.1° | 62.8° |
C5 | C4 | O4 | H4 | 119.8° | 120.2° |
C5 | C4 | O4 | HO4 | 154.5° | 180.0° |
H5 | C5 | O5 | C1 | 59.6° | 58.9° |
H5 | C5 | C4 | C3 | 62.7° | 62.4° |
H5 | C5 | C4 | O4 | 57.8° | 57.5° |
H5 | C5 | C4 | H4 | 177.4° | 177.7° |
O5 | C1 | O1 | C2 | 120.3° | 119.9° |
O5 | C1 | O1 | H1 | 120.6° | 120.0° |
O5 | C1 | C2 | H1 | 120.6° | 120.0° |
O5 | C1 | O1 | HO1 | 74.3° | 60.0° |
O5 | C1 | C2 | O2 | 61.8° | 62.3° |
O5 | C1 | C2 | C3 | 57.9° | 57.6° |
O5 | C1 | C2 | H2 | 178.2° | 177.6° |
O1 | C1 | C2 | H1 | 120.3° | 120.1° |
O1 | C1 | C2 | O2 | 179.0° | 177.7° |
O1 | C1 | C2 | C3 | 61.3° | 62.4° |
O1 | C1 | C2 | H2 | 59.1° | 57.6° |
C2 | C1 | O1 | HO1 | 46.1° | 180.0° |
C1 | C2 | O2 | C3 | 119.2° | 119.7° |
C1 | C2 | O2 | H2 | 120.4° | 120.1° |
C1 | C2 | C3 | H2 | 120.4° | 120.0° |
C1 | C2 | O2 | HO2 | 45.0° | 60.0° |
C1 | C2 | C3 | C4 | 58.5° | 57.0° |
C1 | C2 | C3 | O3 | 180.0° | 176.9° |
C1 | C2 | C3 | H3 | 60.5° | 62.9° |
H1 | C1 | O1 | HO1 | 165.2° | 60.0° |
H1 | C1 | C2 | O2 | 58.7° | 57.6° |
H1 | C1 | C2 | C3 | 178.4° | 177.5° |
H1 | C1 | C2 | H2 | 61.2° | 62.4° |
O2 | C2 | C3 | H2 | 119.9° | 120.1° |
O2 | C2 | C3 | C4 | 61.2° | 63.0° |
O2 | C2 | C3 | O3 | 60.3° | 56.9° |
O2 | C2 | C3 | H3 | 179.7° | 177.2° |
C3 | C2 | O2 | HO2 | 164.2° | 179.7° |
C2 | C3 | C4 | O3 | 120.3° | 119.9° |
C2 | C3 | C4 | H3 | 120.3° | 119.8° |
C2 | C3 | O3 | H3 | 120.3° | 120.2° |
C2 | C3 | O3 | HO3 | 12.3° | 60.0° |
C2 | C3 | C4 | O4 | 179.7° | 176.8° |
C2 | C3 | C4 | H4 | 60.6° | 63.0° |
H2 | C2 | O2 | HO2 | 75.4° | 60.2° |
H2 | C2 | C3 | C4 | 178.9° | 177.0° |
H2 | C2 | C3 | O3 | 59.6° | 63.1° |
H2 | C2 | C3 | H3 | 59.8° | 57.1° |
C4 | C3 | O3 | H3 | 119.1° | 120.2° |
C4 | C3 | O3 | HO3 | 108.3° | 179.5° |
C3 | C4 | O4 | H4 | 119.9° | 120.2° |
C3 | C4 | O4 | HO4 | 85.2° | 60.3° |
O3 | C3 | C4 | O4 | 60.0° | 63.2° |
O3 | C3 | C4 | H4 | 59.6° | 57.0° |
H3 | C3 | O3 | HO3 | 132.7° | 60.3° |
H3 | C3 | C4 | O4 | 59.4° | 57.0° |
H3 | C3 | C4 | H4 | 179.1° | 177.2° |
H4 | C4 | O4 | HO4 | 34.7° | 59.8° |