LG6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.51Å | 1.52Å | |
C1 | O1 | sing | 1.43Å | 1.44Å | |
C1 | C3 | sing | 1.53Å | 1.54Å | |
C1 | H1 | sing | 1.09Å | 1.12Å | |
O2A | C2 | doub | 1.21Å | 1.27Å | |
C2 | O2B | sing | 1.34Å | 1.22Å | |
O2B | H2B | sing | 0.97Å | 0.95Å | |
O1 | HO1 | sing | 0.97Å | 0.95Å | |
C3 | O3 | sing | 1.43Å | 1.44Å | |
C3 | C4 | sing | 1.53Å | 1.54Å | |
C3 | H3 | sing | 1.09Å | 1.11Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
C4 | C5 | sing | 1.53Å | 1.54Å | |
C4 | O4 | sing | 1.43Å | 1.44Å | |
C4 | H4 | sing | 1.09Å | 1.11Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | O5 | sing | 1.43Å | 1.44Å | |
C5 | H5 | sing | 1.09Å | 1.11Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C6 | O6 | sing | 1.43Å | 1.42Å | |
C6 | H61 | sing | 1.09Å | 1.11Å | |
C6 | H62 | sing | 1.09Å | 1.12Å | |
O5 | HO5 | sing | 0.97Å | 0.95Å | |
P | O6 | sing | 1.61Å | 1.51Å | |
P | O1P | doub | 1.48Å | 1.50Å | |
P | O2P | sing | 1.61Å | 1.50Å | |
P | O3P | sing | 1.61Å | 1.48Å | |
O2P | HOP2 | sing | 0.97Å | 0.95Å | |
O3P | HOP3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O1 | 109.3° | 109.5° |
C2 | C1 | C3 | 111.2° | 109.5° |
C2 | C1 | H1 | 108.2° | 109.5° |
C1 | C2 | O2A | 120.0° | 120.0° |
C1 | C2 | O2B | 120.1° | 120.0° |
O1 | C1 | C3 | 109.0° | 109.4° |
O1 | C1 | H1 | 110.6° | 109.4° |
C1 | O1 | HO1 | 109.3° | 106.8° |
C3 | C1 | H1 | 108.6° | 109.5° |
C1 | C3 | O3 | 111.8° | 109.4° |
C1 | C3 | C4 | 109.2° | 109.6° |
C1 | C3 | H3 | 108.6° | 109.4° |
O2A | C2 | O2B | 119.9° | 120.0° |
C2 | O2B | H2B | 120.1° | 120.0° |
O3 | C3 | C4 | 110.8° | 109.5° |
O3 | C3 | H3 | 106.8° | 109.5° |
C3 | O3 | HO3 | 111.8° | 106.8° |
C4 | C3 | H3 | 109.6° | 109.5° |
C3 | C4 | C5 | 110.1° | 109.5° |
C3 | C4 | O4 | 109.7° | 109.5° |
C3 | C4 | H4 | 109.1° | 109.5° |
C5 | C4 | O4 | 110.0° | 109.5° |
C5 | C4 | H4 | 108.8° | 109.5° |
C4 | C5 | C6 | 111.1° | 109.5° |
C4 | C5 | O5 | 109.9° | 109.4° |
C4 | C5 | H5 | 107.8° | 109.4° |
O4 | C4 | H4 | 109.2° | 109.4° |
C4 | O4 | HO4 | 109.7° | 106.8° |
C6 | C5 | O5 | 108.5° | 109.4° |
C6 | C5 | H5 | 109.2° | 109.5° |
C5 | C6 | O6 | 108.7° | 109.5° |
C5 | C6 | H61 | 112.5° | 109.5° |
C5 | C6 | H62 | 112.5° | 109.5° |
O5 | C5 | H5 | 110.3° | 109.5° |
C5 | O5 | HO5 | 110.0° | 106.9° |
O6 | C6 | H61 | 112.5° | 109.5° |
O6 | C6 | H62 | 112.5° | 109.4° |
C6 | O6 | P | 121.4° | 106.9° |
H61 | C6 | H62 | 97.9° | 109.5° |
O6 | P | O1P | 108.0° | 109.4° |
O6 | P | O2P | 110.4° | 109.5° |
O6 | P | O3P | 110.0° | 109.5° |
O1P | P | O2P | 109.6° | 109.4° |
O1P | P | O3P | 110.1° | 109.5° |
O2P | P | O3P | 108.8° | 109.5° |
P | O2P | HOP2 | 110.4° | 106.9° |
P | O3P | HOP3 | 110.0° | 106.8° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O1 | C3 | 121.7° | 120.1° |
C2 | C1 | O1 | H1 | 119.0° | 120.0° |
C2 | C1 | C3 | H1 | 119.0° | 120.0° |
C1 | C2 | O2A | O2B | 179.8° | 180.0° |
C1 | C2 | O2B | H2B | 180.0° | 179.9° |
C2 | C1 | O1 | HO1 | 180.0° | 60.0° |
C2 | C1 | C3 | O3 | 31.8° | 60.0° |
C2 | C1 | C3 | C4 | 154.8° | 180.0° |
C2 | C1 | C3 | H3 | 85.8° | 60.0° |
O1 | C1 | C3 | H1 | 120.5° | 119.9° |
O1 | C1 | C2 | O2A | 38.4° | 0.0° |
O1 | C1 | C2 | O2B | 141.8° | 180.0° |
O1 | C1 | C3 | O3 | 152.4° | 180.0° |
O1 | C1 | C3 | C4 | 84.7° | 59.9° |
O1 | C1 | C3 | H3 | 34.8° | 60.1° |
C3 | C1 | C2 | O2A | 81.9° | 120.0° |
C3 | C1 | C2 | O2B | 97.9° | 60.0° |
C3 | C1 | O1 | HO1 | 58.4° | 60.1° |
C1 | C3 | O3 | C4 | 122.0° | 120.1° |
C1 | C3 | O3 | H3 | 118.6° | 119.9° |
C1 | C3 | C4 | H3 | 118.8° | 120.0° |
C1 | C3 | O3 | HO3 | 180.0° | 60.1° |
C1 | C3 | C4 | C5 | 158.5° | 180.0° |
C1 | C3 | C4 | O4 | 80.3° | 60.0° |
C1 | C3 | C4 | H4 | 39.2° | 59.9° |
H1 | C1 | C2 | O2A | 158.9° | 119.9° |
H1 | C1 | C2 | O2B | 21.4° | 60.1° |
H1 | C1 | O1 | HO1 | 60.9° | 180.0° |
H1 | C1 | C3 | O3 | 87.1° | 60.1° |
H1 | C1 | C3 | C4 | 35.8° | 60.0° |
H1 | C1 | C3 | H3 | 155.3° | 180.0° |
O2A | C2 | O2B | H2B | 0.2° | 0.1° |
O3 | C3 | C4 | H3 | 117.7° | 120.0° |
O3 | C3 | C4 | C5 | 78.0° | 60.0° |
O3 | C3 | C4 | O4 | 43.2° | 60.0° |
O3 | C3 | C4 | H4 | 162.7° | 179.9° |
C4 | C3 | O3 | HO3 | 58.0° | 60.0° |
C3 | C4 | C5 | O4 | 121.0° | 120.0° |
C3 | C4 | C5 | H4 | 119.5° | 120.1° |
C3 | C4 | O4 | H4 | 119.5° | 120.0° |
C3 | C4 | C5 | C6 | 177.6° | 180.0° |
C3 | C4 | C5 | O5 | 62.2° | 60.0° |
C3 | C4 | C5 | H5 | 58.0° | 60.0° |
C3 | C4 | O4 | HO4 | 180.0° | 60.0° |
H3 | C3 | O3 | HO3 | 61.4° | 180.0° |
H3 | C3 | C4 | C5 | 39.7° | 60.0° |
H3 | C3 | C4 | O4 | 160.9° | 180.0° |
H3 | C3 | C4 | H4 | 79.6° | 60.0° |
C5 | C4 | O4 | H4 | 119.3° | 120.0° |
C4 | C5 | C6 | O5 | 120.9° | 119.9° |
C4 | C5 | C6 | H5 | 118.7° | 120.0° |
C4 | C5 | O5 | H5 | 118.7° | 119.9° |
C5 | C4 | O4 | HO4 | 58.8° | 60.1° |
C4 | C5 | C6 | O6 | 55.3° | 180.0° |
C4 | C5 | C6 | H61 | 179.4° | 60.0° |
C4 | C5 | C6 | H62 | 70.0° | 60.0° |
C4 | C5 | O5 | HO5 | 180.0° | 60.0° |
O4 | C4 | C5 | C6 | 61.4° | 60.0° |
O4 | C4 | C5 | O5 | 58.7° | 60.0° |
O4 | C4 | C5 | H5 | 179.0° | 180.0° |
H4 | C4 | C5 | C6 | 58.2° | 60.0° |
H4 | C4 | C5 | O5 | 178.3° | 179.9° |
H4 | C4 | C5 | H5 | 61.4° | 60.1° |
H4 | C4 | O4 | HO4 | 60.5° | 180.0° |
C6 | C5 | O5 | H5 | 119.7° | 120.1° |
C5 | C6 | O6 | H61 | 125.3° | 120.0° |
C5 | C6 | O6 | H62 | 125.2° | 120.0° |
C5 | C6 | H61 | H62 | 118.4° | 120.0° |
C6 | C5 | O5 | HO5 | 58.4° | 60.0° |
C5 | C6 | O6 | P | 102.3° | 180.0° |
O5 | C5 | C6 | O6 | 176.2° | 60.1° |
O5 | C5 | C6 | H61 | 58.4° | 59.9° |
O5 | C5 | C6 | H62 | 51.0° | 179.9° |
H5 | C5 | C6 | O6 | 63.4° | 60.0° |
H5 | C5 | C6 | H61 | 61.9° | 180.0° |
H5 | C5 | C6 | H62 | 171.3° | 60.0° |
H5 | C5 | O5 | HO5 | 61.3° | 180.0° |
O6 | C6 | H61 | H62 | 118.4° | 120.0° |
C6 | O6 | P | O1P | 166.8° | 60.0° |
C6 | O6 | P | O2P | 47.0° | 180.0° |
C6 | O6 | P | O3P | 73.0° | 60.0° |
H61 | C6 | O6 | P | 23.0° | 60.0° |
H62 | C6 | O6 | P | 132.5° | 60.0° |
O6 | P | O1P | O2P | 120.3° | 120.0° |
O6 | P | O1P | O3P | 120.1° | 120.0° |
O6 | P | O2P | O3P | 120.8° | 120.1° |
O6 | P | O2P | HOP2 | 180.0° | 180.0° |
O6 | P | O3P | HOP3 | 180.0° | 60.0° |
O1P | P | O2P | O3P | 120.4° | 120.0° |
O1P | P | O2P | HOP2 | 61.2° | 60.0° |
O1P | P | O3P | HOP3 | 61.1° | 180.0° |
O2P | P | O3P | HOP3 | 59.0° | 60.1° |
O3P | P | O2P | HOP2 | 59.2° | 59.9° |