GLG
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.59Å | |
C1 | O5 | sing | 1.43Å | 1.45Å | |
C1 | C7 | sing | 1.51Å | 1.54Å | |
C1 | H1 | sing | 1.09Å | 1.11Å | |
C2 | C3 | sing | 1.53Å | 1.58Å | |
C2 | O2 | sing | 1.43Å | 1.42Å | |
C2 | H2 | sing | 1.09Å | 1.12Å | |
C3 | C4 | sing | 1.53Å | 1.56Å | |
C3 | O3 | sing | 1.43Å | 1.43Å | |
C3 | H3 | sing | 1.09Å | 1.11Å | |
C4 | C5 | sing | 1.53Å | 1.60Å | |
C4 | O4 | sing | 1.43Å | 1.42Å | |
C4 | H4 | sing | 1.09Å | 1.12Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | O5 | sing | 1.43Å | 1.45Å | |
C5 | H5 | sing | 1.09Å | 1.12Å | |
C6 | O6 | sing | 1.43Å | 1.42Å | |
C6 | H61 | sing | 1.09Å | 1.11Å | |
C6 | H62 | sing | 1.09Å | 1.12Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
O6 | HO6 | sing | 0.97Å | 0.95Å | |
N | C7 | sing | 1.35Å | 1.33Å | |
N | HN1 | sing | 0.97Å | 1.02Å | |
N | HN2 | sing | 0.97Å | 1.02Å | |
C7 | O7 | doub | 1.21Å | 1.23Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O5 | 114.6° | 109.8° |
C2 | C1 | C7 | 115.6° | 109.5° |
C2 | C1 | H1 | 100.6° | 109.4° |
C1 | C2 | C3 | 109.1° | 109.1° |
C1 | C2 | O2 | 108.5° | 109.6° |
C1 | C2 | H2 | 111.0° | 109.6° |
O5 | C1 | C7 | 108.6° | 109.4° |
O5 | C1 | H1 | 108.9° | 109.4° |
C1 | O5 | C5 | 114.6° | 107.6° |
C7 | C1 | H1 | 107.8° | 109.3° |
C1 | C7 | N | 130.3° | 120.1° |
C1 | C7 | O7 | 107.2° | 119.9° |
C3 | C2 | O2 | 111.3° | 109.5° |
C3 | C2 | H2 | 108.1° | 109.6° |
C2 | C3 | C4 | 112.4° | 108.6° |
C2 | C3 | O3 | 110.5° | 109.8° |
C2 | C3 | H3 | 106.0° | 109.6° |
O2 | C2 | H2 | 108.8° | 109.5° |
C2 | O2 | HO2 | 108.5° | 106.8° |
C4 | C3 | O3 | 106.8° | 109.6° |
C4 | C3 | H3 | 109.6° | 109.6° |
C3 | C4 | C5 | 109.8° | 109.0° |
C3 | C4 | O4 | 111.4° | 109.6° |
C3 | C4 | H4 | 108.5° | 109.6° |
O3 | C3 | H3 | 111.6° | 109.5° |
C3 | O3 | HO3 | 110.5° | 106.8° |
C5 | C4 | O4 | 111.1° | 109.5° |
C5 | C4 | H4 | 108.8° | 109.6° |
C4 | C5 | C6 | 109.4° | 109.3° |
C4 | C5 | O5 | 108.4° | 109.7° |
C4 | C5 | H5 | 109.9° | 109.5° |
O4 | C4 | H4 | 107.1° | 109.6° |
C4 | O4 | HO4 | 111.4° | 106.8° |
C6 | C5 | O5 | 108.7° | 109.4° |
C6 | C5 | H5 | 109.7° | 109.4° |
C5 | C6 | O6 | 108.4° | 109.5° |
C5 | C6 | H61 | 112.6° | 109.5° |
C5 | C6 | H62 | 112.6° | 109.5° |
O5 | C5 | H5 | 110.7° | 109.5° |
O6 | C6 | H61 | 112.6° | 109.4° |
O6 | C6 | H62 | 112.6° | 109.5° |
C6 | O6 | HO6 | 108.4° | 106.9° |
H61 | C6 | H62 | 97.8° | 109.4° |
C7 | N | HN1 | 122.3° | 120.0° |
C7 | N | HN2 | 130.3° | 120.0° |
N | C7 | O7 | 122.3° | 120.0° |
HN1 | N | HN2 | 107.2° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O5 | C7 | 131.0° | 120.1° |
C2 | C1 | O5 | H1 | 111.8° | 120.1° |
C2 | C1 | C7 | H1 | 111.7° | 119.9° |
C1 | C2 | C3 | O2 | 119.8° | 120.0° |
C1 | C2 | C3 | H2 | 120.8° | 119.9° |
C1 | C2 | O2 | H2 | 120.9° | 120.2° |
C1 | C2 | C3 | C4 | 47.3° | 53.8° |
C1 | C2 | C3 | O3 | 166.6° | 173.6° |
C1 | C2 | C3 | H3 | 72.4° | 66.0° |
C2 | C1 | O5 | C5 | 57.4° | 67.6° |
C1 | C2 | O2 | HO2 | 180.0° | 60.4° |
C2 | C1 | C7 | N | 69.8° | 142.8° |
C2 | C1 | C7 | O7 | 116.0° | 37.2° |
O5 | C1 | C7 | H1 | 117.9° | 119.8° |
O5 | C1 | C2 | C3 | 47.6° | 61.3° |
O5 | C1 | C2 | O2 | 169.1° | 178.8° |
O5 | C1 | C2 | H2 | 71.4° | 58.6° |
C1 | O5 | C5 | C4 | 61.0° | 67.7° |
C1 | O5 | C5 | C6 | 179.8° | 172.4° |
C1 | O5 | C5 | H5 | 59.6° | 52.5° |
O5 | C1 | C7 | N | 60.6° | 22.5° |
O5 | C1 | C7 | O7 | 113.5° | 157.5° |
C7 | C1 | C2 | C3 | 80.0° | 58.8° |
C7 | C1 | C2 | O2 | 41.5° | 61.1° |
C7 | C1 | C2 | H2 | 161.0° | 178.7° |
C7 | C1 | O5 | C5 | 73.7° | 52.5° |
C1 | C7 | N | O7 | 173.4° | 180.0° |
C1 | C7 | N | HN1 | 6.6° | 180.0° |
C1 | C7 | N | HN2 | 180.0° | 0.3° |
H1 | C1 | C2 | C3 | 164.3° | 178.6° |
H1 | C1 | C2 | O2 | 74.2° | 58.7° |
H1 | C1 | C2 | H2 | 45.2° | 61.5° |
H1 | C1 | O5 | C5 | 169.2° | 172.3° |
H1 | C1 | C7 | N | 178.5° | 97.4° |
H1 | C1 | C7 | O7 | 4.4° | 82.6° |
C3 | C2 | O2 | H2 | 119.0° | 120.1° |
C2 | C3 | C4 | O3 | 121.4° | 120.0° |
C2 | C3 | C4 | H3 | 117.6° | 119.8° |
C2 | C3 | O3 | H3 | 117.6° | 120.4° |
C2 | C3 | C4 | C5 | 54.1° | 53.8° |
C2 | C3 | C4 | O4 | 177.6° | 173.6° |
C2 | C3 | C4 | H4 | 64.7° | 66.1° |
C3 | C2 | O2 | HO2 | 59.8° | 180.0° |
C2 | C3 | O3 | HO3 | 180.0° | 60.7° |
O2 | C2 | C3 | C4 | 167.1° | 173.7° |
O2 | C2 | C3 | O3 | 73.7° | 66.4° |
O2 | C2 | C3 | H3 | 47.3° | 53.9° |
H2 | C2 | C3 | C4 | 73.5° | 66.2° |
H2 | C2 | C3 | O3 | 45.7° | 53.7° |
H2 | C2 | C3 | H3 | 166.7° | 174.0° |
H2 | C2 | O2 | HO2 | 59.2° | 59.8° |
C4 | C3 | O3 | H3 | 119.8° | 120.3° |
C3 | C4 | C5 | O4 | 123.6° | 119.9° |
C3 | C4 | C5 | H4 | 118.7° | 119.9° |
C3 | C4 | O4 | H4 | 118.5° | 120.3° |
C3 | C4 | C5 | C6 | 177.2° | 178.7° |
C3 | C4 | C5 | O5 | 58.8° | 61.3° |
C3 | C4 | C5 | H5 | 62.3° | 58.8° |
C4 | C3 | O3 | HO3 | 57.5° | 180.0° |
C3 | C4 | O4 | HO4 | 180.0° | 60.5° |
O3 | C3 | C4 | C5 | 175.5° | 173.7° |
O3 | C3 | C4 | O4 | 61.0° | 66.4° |
O3 | C3 | C4 | H4 | 56.7° | 53.8° |
H3 | C3 | C4 | C5 | 63.4° | 66.0° |
H3 | C3 | C4 | O4 | 60.0° | 53.8° |
H3 | C3 | C4 | H4 | 177.7° | 174.1° |
H3 | C3 | O3 | HO3 | 62.4° | 59.7° |
C5 | C4 | O4 | H4 | 118.7° | 120.2° |
C4 | C5 | C6 | O5 | 118.2° | 120.2° |
C4 | C5 | C6 | H5 | 120.7° | 119.9° |
C4 | C5 | O5 | H5 | 120.7° | 120.2° |
C4 | C5 | C6 | O6 | 62.5° | 179.7° |
C4 | C5 | C6 | H61 | 172.2° | 59.7° |
C4 | C5 | C6 | H62 | 62.7° | 60.2° |
C5 | C4 | O4 | HO4 | 57.3° | 180.0° |
O4 | C4 | C5 | C6 | 59.2° | 58.8° |
O4 | C4 | C5 | O5 | 177.6° | 178.8° |
O4 | C4 | C5 | H5 | 61.3° | 61.1° |
H4 | C4 | C5 | C6 | 58.5° | 61.4° |
H4 | C4 | C5 | O5 | 59.8° | 58.6° |
H4 | C4 | C5 | H5 | 179.0° | 178.7° |
H4 | C4 | O4 | HO4 | 61.4° | 59.8° |
C6 | C5 | O5 | H5 | 120.5° | 119.9° |
C5 | C6 | O6 | H61 | 125.3° | 120.0° |
C5 | C6 | O6 | H62 | 125.3° | 120.1° |
C5 | C6 | H61 | H62 | 118.6° | 120.0° |
C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
O5 | C5 | C6 | O6 | 55.7° | 60.1° |
O5 | C5 | C6 | H61 | 69.6° | 179.9° |
O5 | C5 | C6 | H62 | 179.1° | 60.0° |
H5 | C5 | C6 | O6 | 176.8° | 59.9° |
H5 | C5 | C6 | H61 | 51.5° | 60.1° |
H5 | C5 | C6 | H62 | 57.9° | 179.9° |
O6 | C6 | H61 | H62 | 118.5° | 119.9° |
H61 | C6 | O6 | HO6 | 54.7° | 59.9° |
H62 | C6 | O6 | HO6 | 54.7° | 60.0° |
C7 | N | HN1 | HN2 | 174.7° | 179.7° |
HN1 | N | C7 | O7 | 180.0° | 0.0° |
HN2 | N | C7 | O7 | 6.6° | 179.7° |