P6P
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3P | P | doub | 1.48Å | 1.55Å | |
O6 | P | sing | 1.61Å | 1.61Å | |
P | O1P | sing | 1.61Å | 1.51Å | |
P | O2P | sing | 1.61Å | 1.50Å | |
C2 | C1 | sing | 1.53Å | 1.54Å | |
O1 | C1 | sing | 1.43Å | 1.42Å | |
C1 | H11 | sing | 1.09Å | 1.10Å | |
C1 | H12 | sing | 1.09Å | 1.10Å | |
O1 | HO1 | sing | 0.97Å | 0.95Å | |
C3 | C2 | sing | 1.54Å | 1.57Å | |
C2 | O2 | sing | 1.43Å | 1.46Å | |
C2 | O5 | sing | 1.44Å | 1.44Å | |
O2 | HO2 | sing | 0.97Å | 0.95Å | |
C4 | C3 | sing | 1.55Å | 1.56Å | |
O3 | C3 | sing | 1.43Å | 1.47Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
O3 | HO3 | sing | 0.97Å | 0.95Å | |
O4 | C4 | sing | 1.43Å | 1.42Å | |
C4 | C5 | sing | 1.54Å | 1.55Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C5 | C6 | sing | 1.53Å | 1.54Å | |
C5 | O5 | sing | 1.44Å | 1.42Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C6 | O6 | sing | 1.43Å | 1.43Å | |
C6 | H61 | sing | 1.09Å | 1.10Å | |
C6 | H62 | sing | 1.09Å | 1.10Å | |
O1P | HO1P | sing | 0.97Å | 0.95Å | |
O2P | HO2P | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3P | P | O6 | 109.2° | 109.5° |
O3P | P | O1P | 114.9° | 109.5° |
O3P | P | O2P | 109.6° | 109.5° |
O6 | P | O1P | 104.9° | 109.5° |
O6 | P | O2P | 111.9° | 109.5° |
P | O6 | C6 | 124.7° | 123.0° |
O1P | P | O2P | 106.3° | 109.5° |
P | O1P | HO1P | 109.5° | 114.0° |
P | O2P | HO2P | 109.5° | 114.0° |
C2 | C1 | O1 | 113.3° | 109.5° |
C2 | C1 | H11 | 108.2° | 109.4° |
C2 | C1 | H12 | 108.2° | 109.4° |
C1 | C2 | C3 | 120.1° | 110.4° |
C1 | C2 | O2 | 108.8° | 110.3° |
C1 | C2 | O5 | 102.7° | 110.4° |
O1 | C1 | H11 | 108.2° | 109.5° |
O1 | C1 | H12 | 108.2° | 109.5° |
C1 | O1 | HO1 | 109.5° | 114.0° |
H11 | C1 | H12 | 110.7° | 109.5° |
C3 | C2 | O2 | 108.9° | 110.4° |
C3 | C2 | O5 | 107.0° | 104.9° |
C2 | C3 | C4 | 101.3° | 104.1° |
C2 | C3 | O3 | 116.7° | 110.5° |
C2 | C3 | H3 | 114.4° | 110.5° |
O2 | C2 | O5 | 108.9° | 110.4° |
C2 | O2 | HO2 | 109.5° | 114.0° |
C2 | O5 | C5 | 113.1° | 105.2° |
C4 | C3 | O3 | 119.1° | 110.6° |
C4 | C3 | H3 | 111.7° | 110.6° |
C3 | C4 | O4 | 118.1° | 110.5° |
C3 | C4 | C5 | 107.0° | 104.0° |
C3 | C4 | H4 | 104.1° | 110.5° |
O3 | C3 | H3 | 94.4° | 110.5° |
C3 | O3 | HO3 | 109.5° | 114.0° |
O4 | C4 | C5 | 105.4° | 110.5° |
O4 | C4 | H4 | 105.8° | 110.6° |
C4 | O4 | HO4 | 109.5° | 114.0° |
C5 | C4 | H4 | 117.1° | 110.6° |
C4 | C5 | C6 | 115.6° | 110.4° |
C4 | C5 | O5 | 105.8° | 104.9° |
C4 | C5 | H5 | 107.9° | 110.4° |
C6 | C5 | O5 | 109.4° | 110.4° |
C6 | C5 | H5 | 104.2° | 110.3° |
C5 | C6 | O6 | 111.4° | 109.5° |
C5 | C6 | H61 | 108.8° | 109.4° |
C5 | C6 | H62 | 108.8° | 109.4° |
O5 | C5 | H5 | 114.3° | 110.4° |
O6 | C6 | H61 | 108.8° | 109.5° |
O6 | C6 | H62 | 108.8° | 109.5° |
H61 | C6 | H62 | 110.1° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3P | P | O6 | O1P | 123.6° | 120.0° |
O3P | P | O6 | O2P | 121.6° | 120.0° |
O3P | P | O1P | O2P | 121.4° | 120.0° |
O3P | P | O6 | C6 | 34.7° | 55.0° |
O3P | P | O1P | HO1P | 0.0° | 60.0° |
O3P | P | O2P | HO2P | 0.0° | 180.0° |
O6 | P | O1P | O2P | 118.7° | 120.0° |
P | O6 | C6 | C5 | 159.8° | 180.0° |
P | O6 | C6 | H61 | 39.8° | 60.0° |
P | O6 | C6 | H62 | 80.2° | 60.0° |
O6 | P | O1P | HO1P | 119.9° | 180.0° |
O6 | P | O2P | HO2P | 121.4° | 60.0° |
O1P | P | O6 | C6 | 158.3° | 175.0° |
O1P | P | O2P | HO2P | 124.7° | 60.0° |
O2P | P | O6 | C6 | 86.9° | 65.0° |
O2P | P | O1P | HO1P | 121.4° | 60.0° |
C2 | C1 | O1 | H11 | 120.0° | 120.0° |
C2 | C1 | O1 | H12 | 120.0° | 120.0° |
C2 | C1 | H11 | H12 | 118.4° | 120.0° |
C2 | C1 | O1 | HO1 | 180.0° | 180.0° |
C1 | C2 | C3 | O2 | 126.3° | 122.2° |
C1 | C2 | C3 | O5 | 116.2° | 118.9° |
C1 | C2 | O2 | O5 | 111.2° | 122.2° |
C1 | C2 | O2 | HO2 | 180.0° | 59.3° |
C1 | C2 | C3 | C4 | 93.0° | 142.8° |
C1 | C2 | C3 | O3 | 37.9° | 24.0° |
C1 | C2 | C3 | H3 | 146.7° | 98.5° |
C1 | C2 | O5 | C5 | 111.4° | 159.3° |
O1 | C1 | H11 | H12 | 118.4° | 120.0° |
O1 | C1 | C2 | C3 | 0.0° | 178.5° |
O1 | C1 | C2 | O2 | 126.3° | 59.3° |
O1 | C1 | C2 | O5 | 118.4° | 62.9° |
H11 | C1 | O1 | HO1 | 60.0° | 60.0° |
H11 | C1 | C2 | C3 | 120.0° | 61.5° |
H11 | C1 | C2 | O2 | 6.3° | 60.7° |
H11 | C1 | C2 | O5 | 121.6° | 177.1° |
H12 | C1 | O1 | HO1 | 60.0° | 60.0° |
H12 | C1 | C2 | C3 | 120.1° | 58.5° |
H12 | C1 | C2 | O2 | 113.6° | 179.3° |
H12 | C1 | C2 | O5 | 1.7° | 57.1° |
C3 | C2 | O2 | O5 | 116.3° | 115.5° |
C3 | C2 | O2 | HO2 | 47.5° | 178.4° |
C2 | C3 | C4 | O3 | 129.4° | 118.7° |
C2 | C3 | C4 | H3 | 122.2° | 118.7° |
C2 | C3 | O3 | H3 | 120.2° | 122.6° |
C2 | C3 | O3 | HO3 | 180.0° | 180.0° |
C2 | C3 | C4 | O4 | 141.2° | 118.6° |
C2 | C3 | C4 | C5 | 22.7° | 0.1° |
C2 | C3 | C4 | H4 | 101.9° | 118.6° |
C3 | C2 | O5 | C5 | 15.9° | 40.3° |
O2 | C2 | C3 | C4 | 140.8° | 95.0° |
O2 | C2 | C3 | O3 | 88.4° | 146.3° |
O2 | C2 | C3 | H3 | 20.4° | 23.7° |
O2 | C2 | O5 | C5 | 133.3° | 78.5° |
O5 | C2 | O2 | HO2 | 68.8° | 62.9° |
O5 | C2 | C3 | C4 | 23.3° | 23.9° |
O5 | C2 | C3 | O3 | 154.1° | 94.9° |
O5 | C2 | C3 | H3 | 97.1° | 142.6° |
C2 | O5 | C5 | C4 | 0.8° | 40.4° |
C2 | O5 | C5 | C6 | 124.3° | 159.2° |
C2 | O5 | C5 | H5 | 119.4° | 78.5° |
C4 | C3 | O3 | H3 | 117.9° | 122.7° |
C4 | C3 | O3 | HO3 | 58.0° | 65.3° |
C3 | C4 | O4 | C5 | 119.3° | 114.6° |
C3 | C4 | O4 | H4 | 116.0° | 122.7° |
C3 | C4 | C5 | H4 | 116.3° | 118.7° |
C3 | C4 | O4 | HO4 | 180.0° | 61.5° |
C3 | C4 | C5 | C6 | 135.8° | 142.8° |
C3 | C4 | C5 | O5 | 14.6° | 24.0° |
C3 | C4 | C5 | H5 | 108.1° | 94.9° |
O3 | C3 | C4 | O4 | 89.4° | 122.7° |
O3 | C3 | C4 | C5 | 152.1° | 118.7° |
O3 | C3 | C4 | H4 | 27.5° | 0.0° |
H3 | C3 | O3 | HO3 | 59.8° | 57.4° |
H3 | C3 | C4 | O4 | 19.0° | 0.0° |
H3 | C3 | C4 | C5 | 99.5° | 118.6° |
H3 | C3 | C4 | H4 | 135.9° | 122.7° |
O4 | C4 | C5 | H4 | 117.2° | 122.8° |
O4 | C4 | C5 | C6 | 97.7° | 98.6° |
O4 | C4 | C5 | O5 | 141.1° | 142.5° |
O4 | C4 | C5 | H5 | 18.4° | 23.6° |
C5 | C4 | O4 | HO4 | 60.7° | 176.1° |
C4 | C5 | C6 | O5 | 119.2° | 115.5° |
C4 | C5 | C6 | H5 | 118.2° | 122.3° |
C4 | C5 | O5 | H5 | 118.5° | 118.9° |
C4 | C5 | C6 | O6 | 171.0° | 175.0° |
C4 | C5 | C6 | H61 | 69.0° | 55.0° |
C4 | C5 | C6 | H62 | 51.0° | 65.0° |
H4 | C4 | O4 | HO4 | 64.0° | 61.2° |
H4 | C4 | C5 | C6 | 19.6° | 24.2° |
H4 | C4 | C5 | O5 | 101.6° | 94.7° |
H4 | C4 | C5 | H5 | 135.7° | 146.4° |
C6 | C5 | O5 | H5 | 116.3° | 122.2° |
C5 | C6 | O6 | H61 | 120.0° | 120.0° |
C5 | C6 | O6 | H62 | 120.0° | 120.0° |
C5 | C6 | H61 | H62 | 119.2° | 119.9° |
O5 | C5 | C6 | O6 | 51.8° | 69.5° |
O5 | C5 | C6 | H61 | 171.8° | 170.4° |
O5 | C5 | C6 | H62 | 68.2° | 50.5° |
H5 | C5 | C6 | O6 | 70.7° | 52.8° |
H5 | C5 | C6 | H61 | 49.2° | 67.3° |
H5 | C5 | C6 | H62 | 169.3° | 172.8° |
O6 | C6 | H61 | H62 | 119.2° | 120.0° |