7N5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1A | C1 | doub | 1.21Å | 1.25Å | |
| C1 | O1B | sing | 1.35Å | 1.26Å | |
| C1 | C2 | sing | 1.49Å | 1.45Å | |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C2 | O2 | doub | 1.21Å | 1.21Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| O1B | H10 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1A | C1 | O1B | 121.8° | 120.0° |
| O1A | C1 | C2 | 120.8° | 120.0° |
| O1B | C1 | C2 | 117.4° | 120.0° |
| C1 | O1B | H10 | 109.5° | 117.0° |
| C1 | C2 | C3 | 120.0° | 120.0° |
| C1 | C2 | O2 | 118.3° | 120.0° |
| C2 | C3 | C4 | 114.4° | 109.4° |
| C3 | C2 | O2 | 121.7° | 120.1° |
| C2 | C3 | H1 | 108.2° | 109.5° |
| C2 | C3 | H2 | 108.3° | 109.5° |
| C3 | C4 | C5 | 109.6° | 109.5° |
| C4 | C3 | H1 | 108.2° | 109.4° |
| C4 | C3 | H2 | 108.2° | 109.4° |
| C3 | C4 | H5 | 109.4° | 109.5° |
| C3 | C4 | H6 | 109.5° | 109.5° |
| C4 | C5 | C6 | 113.3° | 109.5° |
| C4 | C5 | H3 | 108.5° | 109.5° |
| C4 | C5 | H4 | 108.5° | 109.5° |
| C5 | C4 | H5 | 109.4° | 109.5° |
| C5 | C4 | H6 | 109.4° | 109.5° |
| C6 | C5 | H3 | 108.5° | 109.5° |
| C6 | C5 | H4 | 108.5° | 109.5° |
| C5 | C6 | H7 | 109.5° | 109.5° |
| C5 | C6 | H8 | 109.5° | 109.5° |
| C5 | C6 | H9 | 109.5° | 109.5° |
| H1 | C3 | H2 | 109.5° | 109.5° |
| H3 | C5 | H4 | 109.5° | 109.5° |
| H5 | C4 | H6 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.5° | 109.5° |
| H7 | C6 | H9 | 109.4° | 109.5° |
| H8 | C6 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1A | C1 | O1B | C2 | 178.8° | 180.0° |
| O1A | C1 | C2 | C3 | 16.5° | 0.0° |
| O1A | C1 | C2 | O2 | 166.0° | 180.0° |
| O1A | C1 | O1B | H10 | 0.0° | 0.0° |
| O1B | C1 | C2 | C3 | 164.7° | 180.0° |
| O1B | C1 | C2 | O2 | 12.9° | 0.0° |
| C1 | C2 | C3 | O2 | 177.5° | 180.0° |
| C1 | C2 | C3 | C4 | 178.2° | 180.0° |
| C1 | C2 | C3 | H1 | 57.4° | 60.0° |
| C1 | C2 | C3 | H2 | 61.1° | 60.0° |
| C2 | C1 | O1B | H10 | 178.8° | 180.0° |
| C2 | C3 | C4 | H1 | 120.7° | 120.0° |
| C2 | C3 | C4 | H2 | 120.7° | 120.0° |
| C2 | C3 | C4 | C5 | 171.7° | 180.0° |
| C2 | C3 | H1 | H2 | 117.8° | 120.1° |
| C2 | C3 | C4 | H5 | 68.3° | 60.0° |
| C2 | C3 | C4 | H6 | 51.6° | 60.0° |
| C4 | C3 | C2 | O2 | 0.7° | 0.0° |
| C3 | C4 | C5 | H5 | 120.0° | 120.0° |
| C3 | C4 | C5 | H6 | 120.0° | 120.0° |
| C3 | C4 | C5 | C6 | 171.0° | 180.0° |
| C4 | C3 | H1 | H2 | 117.7° | 119.9° |
| C3 | C4 | C5 | H3 | 68.4° | 60.0° |
| C3 | C4 | C5 | H4 | 50.4° | 60.0° |
| C3 | C4 | H5 | H6 | 120.0° | 120.0° |
| O2 | C2 | C3 | H1 | 120.0° | 120.0° |
| O2 | C2 | C3 | H2 | 121.4° | 120.0° |
| C4 | C5 | C6 | H3 | 120.6° | 120.0° |
| C4 | C5 | C6 | H4 | 120.6° | 120.0° |
| C5 | C4 | C3 | H1 | 50.9° | 60.0° |
| C5 | C4 | C3 | H2 | 67.6° | 60.0° |
| C4 | C5 | H3 | H4 | 118.3° | 120.0° |
| C5 | C4 | H5 | H6 | 119.9° | 120.0° |
| C4 | C5 | C6 | H7 | 180.0° | 60.0° |
| C4 | C5 | C6 | H8 | 60.0° | 60.0° |
| C4 | C5 | C6 | H9 | 60.0° | 180.0° |
| C6 | C5 | H3 | H4 | 118.2° | 120.0° |
| C6 | C5 | C4 | H5 | 51.0° | 60.0° |
| C6 | C5 | C4 | H6 | 69.0° | 60.0° |
| C5 | C6 | H7 | H8 | 120.0° | 120.0° |
| C5 | C6 | H7 | H9 | 120.0° | 120.0° |
| C5 | C6 | H8 | H9 | 120.0° | 120.0° |
| H1 | C3 | C4 | H5 | 170.9° | 60.0° |
| H1 | C3 | C4 | H6 | 69.1° | 180.0° |
| H2 | C3 | C4 | H5 | 52.4° | 180.0° |
| H2 | C3 | C4 | H6 | 172.4° | 60.0° |
| H3 | C5 | C4 | H5 | 171.5° | 180.0° |
| H3 | C5 | C4 | H6 | 51.6° | 60.0° |
| H3 | C5 | C6 | H7 | 59.4° | 180.0° |
| H3 | C5 | C6 | H8 | 179.4° | 60.0° |
| H3 | C5 | C6 | H9 | 60.6° | 60.0° |
| H4 | C5 | C4 | H5 | 69.6° | 60.0° |
| H4 | C5 | C4 | H6 | 170.5° | 180.0° |
| H4 | C5 | C6 | H7 | 59.5° | 60.0° |
| H4 | C5 | C6 | H8 | 60.6° | 180.0° |
| H4 | C5 | C6 | H9 | 179.4° | 60.0° |
| H7 | C6 | H8 | H9 | 120.0° | 120.0° |
