4NO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O14 | P13 | doub | 1.48Å | 1.52Å | |
| O11 | C10 | doub | 1.22Å | 1.24Å | |
| O15 | P13 | sing | 1.61Å | 1.53Å | |
| P13 | O16 | sing | 1.61Å | 1.51Å | |
| P13 | C4 | sing | 1.81Å | 1.75Å | |
| C10 | O12 | sing | 1.35Å | 1.25Å | |
| C10 | C5 | sing | 1.48Å | 1.50Å | |
| C4 | C5 | doub | 1.40Å | 1.42Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | N1 | sing | 1.48Å | 1.39Å | |
| O9 | N1 | sing | 1.22Å | 1.38Å | |
| N1 | O8 | doub | 1.22Å | 1.39Å | |
| O16 | H1 | sing | 0.97Å | 0.95Å | |
| O15 | H2 | sing | 0.97Å | 0.95Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| O12 | H6 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O14 | P13 | O15 | 110.5° | 109.4° |
| O14 | P13 | O16 | 116.5° | 109.5° |
| O14 | P13 | C4 | 104.3° | 109.4° |
| O11 | C10 | O12 | 121.6° | 120.0° |
| O11 | C10 | C5 | 120.1° | 120.0° |
| O15 | P13 | O16 | 111.0° | 109.5° |
| O15 | P13 | C4 | 108.5° | 109.5° |
| P13 | O15 | H2 | 109.5° | 114.0° |
| O16 | P13 | C4 | 105.4° | 109.5° |
| P13 | O16 | H1 | 109.5° | 114.0° |
| P13 | C4 | C5 | 125.6° | 120.1° |
| P13 | C4 | C3 | 116.0° | 120.1° |
| O12 | C10 | C5 | 118.2° | 120.0° |
| C10 | O12 | H6 | 109.5° | 117.0° |
| C10 | C5 | C4 | 124.5° | 120.2° |
| C10 | C5 | C6 | 114.2° | 120.1° |
| C5 | C4 | C3 | 118.4° | 119.9° |
| C4 | C5 | C6 | 121.3° | 119.7° |
| C4 | C3 | C2 | 119.5° | 120.1° |
| C4 | C3 | H3 | 120.3° | 120.0° |
| C5 | C6 | C7 | 119.8° | 119.8° |
| C5 | C6 | H5 | 120.1° | 120.1° |
| C3 | C2 | C7 | 122.1° | 120.3° |
| C3 | C2 | N1 | 119.5° | 119.9° |
| C2 | C3 | H3 | 120.2° | 119.9° |
| C6 | C7 | C2 | 118.9° | 120.2° |
| C6 | C7 | H4 | 120.6° | 119.9° |
| C7 | C6 | H5 | 120.1° | 120.1° |
| C7 | C2 | N1 | 118.4° | 119.8° |
| C2 | C7 | H4 | 120.5° | 119.9° |
| C2 | N1 | O9 | 119.3° | 120.0° |
| C2 | N1 | O8 | 118.7° | 120.0° |
| O9 | N1 | O8 | 122.1° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O14 | P13 | O15 | O16 | 130.9° | 120.0° |
| O14 | P13 | O15 | C4 | 113.7° | 119.9° |
| O14 | P13 | O16 | C4 | 115.0° | 120.0° |
| O14 | P13 | C4 | C5 | 55.2° | 170.5° |
| O14 | P13 | C4 | C3 | 126.0° | 9.8° |
| O14 | P13 | O16 | H1 | 0.0° | 59.9° |
| O14 | P13 | O15 | H2 | 0.0° | 60.0° |
| O11 | C10 | O12 | C5 | 178.7° | 180.0° |
| O11 | C10 | C5 | C4 | 32.1° | 8.0° |
| O11 | C10 | C5 | C6 | 147.3° | 172.3° |
| O11 | C10 | O12 | H6 | 0.0° | 0.0° |
| O15 | P13 | O16 | C4 | 117.3° | 120.0° |
| O15 | P13 | C4 | C5 | 173.0° | 50.6° |
| O15 | P13 | C4 | C3 | 8.2° | 129.8° |
| O15 | P13 | O16 | H1 | 127.7° | 179.9° |
| O16 | P13 | C4 | C5 | 68.0° | 69.5° |
| O16 | P13 | C4 | C3 | 110.8° | 110.2° |
| O16 | P13 | O15 | H2 | 130.9° | 180.0° |
| P13 | C4 | C5 | C10 | 1.1° | 0.1° |
| P13 | C4 | C5 | C3 | 178.8° | 179.7° |
| P13 | C4 | C5 | C6 | 179.6° | 179.8° |
| P13 | C4 | C3 | C2 | 179.7° | 179.9° |
| C4 | P13 | O16 | H1 | 115.0° | 60.1° |
| C4 | P13 | O15 | H2 | 113.8° | 60.0° |
| P13 | C4 | C3 | H3 | 0.3° | 0.1° |
| O12 | C10 | C5 | C4 | 149.2° | 172.0° |
| O12 | C10 | C5 | C6 | 31.4° | 7.7° |
| C10 | C5 | C4 | C6 | 179.3° | 179.7° |
| C10 | C5 | C4 | C3 | 179.8° | 179.8° |
| C10 | C5 | C6 | C7 | 180.0° | 179.7° |
| C10 | C5 | C6 | H5 | 0.0° | 0.0° |
| C5 | C10 | O12 | H6 | 178.7° | 180.0° |
| C5 | C4 | C3 | C2 | 0.8° | 0.3° |
| C4 | C5 | C6 | C7 | 0.6° | 0.5° |
| C5 | C4 | C3 | H3 | 179.2° | 179.7° |
| C4 | C5 | C6 | H5 | 179.4° | 179.7° |
| C3 | C4 | C5 | C6 | 0.8° | 0.5° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | C7 | 0.5° | 0.0° |
| C4 | C3 | C2 | N1 | 179.5° | 180.0° |
| C5 | C6 | C7 | H5 | 180.0° | 179.7° |
| C5 | C6 | C7 | C2 | 0.3° | 0.3° |
| C5 | C6 | C7 | H4 | 179.7° | 179.8° |
| C3 | C2 | C7 | C6 | 0.3° | 0.1° |
| C3 | C2 | C7 | N1 | 179.0° | 180.0° |
| C3 | C2 | N1 | O9 | 0.3° | 180.0° |
| C3 | C2 | N1 | O8 | 179.8° | 0.0° |
| C3 | C2 | C7 | H4 | 179.7° | 179.9° |
| C6 | C7 | C2 | H4 | 180.0° | 179.9° |
| C6 | C7 | C2 | N1 | 179.2° | 180.0° |
| C7 | C2 | N1 | O9 | 179.3° | 0.0° |
| C7 | C2 | N1 | O8 | 0.8° | 180.0° |
| C7 | C2 | C3 | H3 | 179.5° | 180.0° |
| C2 | C7 | C6 | H5 | 179.7° | 180.0° |
| C2 | N1 | O9 | O8 | 179.9° | 180.0° |
| N1 | C2 | C3 | H3 | 0.5° | 0.0° |
| N1 | C2 | C7 | H4 | 0.8° | 0.1° |
| H4 | C7 | C6 | H5 | 0.3° | 0.1° |
