CCP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P | O1P | doub | 1.48Å | 1.60Å | |
| P | O2P | sing | 1.61Å | 1.54Å | |
| P | O3P | sing | 1.61Å | 1.58Å | |
| P | C1 | sing | 1.82Å | 1.87Å | |
| O2P | HOP2 | sing | 0.97Å | 0.95Å | |
| O3P | HOP3 | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | H11 | sing | 1.09Å | 1.11Å | |
| C1 | H12 | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.58Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C4 | H43 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1P | P | O2P | 110.9° | 109.4° |
| O1P | P | O3P | 106.9° | 109.5° |
| O1P | P | C1 | 111.2° | 109.4° |
| O2P | P | O3P | 109.7° | 109.5° |
| O2P | P | C1 | 111.6° | 109.5° |
| P | O2P | HOP2 | 110.9° | 106.8° |
| O3P | P | C1 | 106.3° | 109.5° |
| P | O3P | HOP3 | 107.0° | 106.8° |
| P | C1 | C2 | 104.7° | 109.5° |
| P | C1 | H11 | 114.1° | 109.5° |
| P | C1 | H12 | 114.0° | 109.4° |
| C2 | C1 | H11 | 114.0° | 109.5° |
| C2 | C1 | H12 | 114.0° | 109.4° |
| C1 | C2 | C3 | 107.0° | 109.6° |
| C1 | C2 | H21 | 113.1° | 109.5° |
| C1 | C2 | H22 | 113.2° | 109.4° |
| H11 | C1 | H12 | 96.5° | 109.4° |
| C3 | C2 | H21 | 113.1° | 109.5° |
| C3 | C2 | H22 | 113.1° | 109.5° |
| C2 | C3 | C4 | 121.5° | 109.6° |
| C2 | C3 | H31 | 107.9° | 109.5° |
| C2 | C3 | H32 | 107.9° | 109.4° |
| H21 | C2 | H22 | 97.3° | 109.4° |
| C4 | C3 | H31 | 108.0° | 109.5° |
| C4 | C3 | H32 | 107.9° | 109.5° |
| C3 | C4 | H41 | 121.5° | 109.6° |
| C3 | C4 | H42 | 107.9° | 109.5° |
| C3 | C4 | H43 | 107.9° | 109.5° |
| H31 | C3 | H32 | 101.9° | 109.4° |
| H41 | C4 | H42 | 107.9° | 109.4° |
| H41 | C4 | H43 | 108.0° | 109.5° |
| H42 | C4 | H43 | 102.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1P | P | O2P | O3P | 117.9° | 120.0° |
| O1P | P | O2P | C1 | 124.5° | 119.9° |
| O1P | P | O3P | C1 | 118.8° | 119.9° |
| O1P | P | O2P | HOP2 | 180.0° | 60.1° |
| O1P | P | O3P | HOP3 | 180.0° | 180.0° |
| O1P | P | C1 | C2 | 71.8° | 60.1° |
| O1P | P | C1 | H11 | 53.4° | 60.0° |
| O1P | P | C1 | H12 | 163.0° | 180.0° |
| O2P | P | O3P | C1 | 120.8° | 120.1° |
| O2P | P | O3P | HOP3 | 59.6° | 60.1° |
| O2P | P | C1 | C2 | 163.8° | 180.0° |
| O2P | P | C1 | H11 | 70.9° | 59.9° |
| O2P | P | C1 | H12 | 38.6° | 60.0° |
| O3P | P | O2P | HOP2 | 62.1° | 59.9° |
| O3P | P | C1 | C2 | 44.2° | 59.9° |
| O3P | P | C1 | H11 | 169.5° | 180.0° |
| O3P | P | C1 | H12 | 81.0° | 60.1° |
| C1 | P | O2P | HOP2 | 55.5° | 180.0° |
| C1 | P | O3P | HOP3 | 61.2° | 60.0° |
| P | C1 | C2 | H11 | 125.3° | 120.1° |
| P | C1 | C2 | H12 | 125.3° | 120.0° |
| P | C1 | H11 | H12 | 120.0° | 119.9° |
| P | C1 | C2 | C3 | 176.1° | 180.0° |
| P | C1 | C2 | H21 | 58.7° | 59.9° |
| P | C1 | C2 | H22 | 50.8° | 60.0° |
| C2 | C1 | H11 | H12 | 119.9° | 119.9° |
| C1 | C2 | C3 | H21 | 125.3° | 120.1° |
| C1 | C2 | C3 | H22 | 125.3° | 119.9° |
| C1 | C2 | H21 | H22 | 119.1° | 119.9° |
| C1 | C2 | C3 | C4 | 54.2° | 180.0° |
| C1 | C2 | C3 | H31 | 71.1° | 59.9° |
| C1 | C2 | C3 | H32 | 179.5° | 60.0° |
| H11 | C1 | C2 | C3 | 50.8° | 59.9° |
| H11 | C1 | C2 | H21 | 176.1° | 180.0° |
| H11 | C1 | C2 | H22 | 74.5° | 60.1° |
| H12 | C1 | C2 | C3 | 58.7° | 60.0° |
| H12 | C1 | C2 | H21 | 66.6° | 60.1° |
| H12 | C1 | C2 | H22 | 176.0° | 180.0° |
| C3 | C2 | H21 | H22 | 119.0° | 119.9° |
| C2 | C3 | C4 | H31 | 125.2° | 120.1° |
| C2 | C3 | C4 | H32 | 125.3° | 120.0° |
| C2 | C3 | H31 | H32 | 113.5° | 119.9° |
| C2 | C3 | C4 | H41 | 180.0° | 180.0° |
| C2 | C3 | C4 | H42 | 54.8° | 60.0° |
| C2 | C3 | C4 | H43 | 54.7° | 60.0° |
| H21 | C2 | C3 | C4 | 179.4° | 59.9° |
| H21 | C2 | C3 | H31 | 54.2° | 180.0° |
| H21 | C2 | C3 | H32 | 55.2° | 60.1° |
| H22 | C2 | C3 | C4 | 71.2° | 60.0° |
| H22 | C2 | C3 | H31 | 163.5° | 60.1° |
| H22 | C2 | C3 | H32 | 54.1° | 180.0° |
| C4 | C3 | H31 | H32 | 113.5° | 120.0° |
| C3 | C4 | H41 | H42 | 125.2° | 120.0° |
| C3 | C4 | H41 | H43 | 125.2° | 120.0° |
| C3 | C4 | H42 | H43 | 113.5° | 120.0° |
| H31 | C3 | C4 | H41 | 54.8° | 59.9° |
| H31 | C3 | C4 | H42 | 180.0° | 60.1° |
| H31 | C3 | C4 | H43 | 70.5° | 179.9° |
| H32 | C3 | C4 | H41 | 54.7° | 60.0° |
| H32 | C3 | C4 | H42 | 70.5° | 180.0° |
| H32 | C3 | C4 | H43 | 180.0° | 60.0° |
| H41 | C4 | H42 | H43 | 113.6° | 120.0° |
