7NX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O8 | C8 | doub | 1.21Å | 1.19Å | |
| C8 | O7 | sing | 1.34Å | 1.45Å | |
| C8 | OXT | sing | 1.35Å | 1.51Å | |
| OXT | H2 | sing | 0.97Å | 0.95Å | |
| O7 | C7 | sing | 1.45Å | 88.64Å | |
| C7 | C1 | sing | 1.53Å | 0.00Å | |
| C1 | C2 | sing | 1.53Å | 0.00Å | |
| C2 | C3 | sing | 1.53Å | 0.00Å | |
| C3 | C4 | sing | 1.53Å | 0.00Å | |
| C4 | C5 | sing | 1.53Å | 0.00Å | |
| C5 | C6 | sing | 1.53Å | 0.00Å | |
| C6 | C1 | sing | 1.53Å | 0.00Å | |
| C7 | H1 | sing | 1.09Å | 0.00Å | |
| C7 | H3 | sing | 1.09Å | 0.00Å | |
| C1 | H4 | sing | 1.09Å | 0.00Å | |
| C2 | H5 | sing | 1.09Å | 0.00Å | |
| C2 | H6 | sing | 1.09Å | 0.00Å | |
| C3 | H7 | sing | 1.09Å | 0.00Å | |
| C3 | H8 | sing | 1.09Å | 0.00Å | |
| C4 | H9 | sing | 1.09Å | 0.00Å | |
| C4 | H10 | sing | 1.09Å | 0.00Å | |
| C5 | H11 | sing | 1.09Å | 0.00Å | |
| C5 | H12 | sing | 1.09Å | 0.00Å | |
| C6 | H13 | sing | 1.09Å | 0.00Å | |
| C6 | H14 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O8 | C8 | O7 | 120.3° | 120.0° |
| O8 | C8 | OXT | 120.5° | 120.0° |
| O7 | C8 | OXT | 119.2° | 120.0° |
| C8 | O7 | C7 | 115.8° | 117.1° |
| C8 | OXT | H2 | 109.5° | 117.0° |
| O7 | C7 | C1 | 90.0° | 109.5° |
| O7 | C7 | H1 | 90.0° | 109.5° |
| O7 | C7 | H3 | 90.0° | 109.5° |
| C7 | C1 | C2 | 90.0° | 109.5° |
| C7 | C1 | C6 | 90.0° | 109.5° |
| C1 | C7 | H1 | 90.0° | 109.5° |
| C1 | C7 | H3 | 90.0° | 109.5° |
| C7 | C1 | H4 | 90.0° | 109.5° |
| C1 | C2 | C3 | 90.0° | 109.5° |
| C2 | C1 | C6 | 90.0° | 109.4° |
| C2 | C1 | H4 | 90.0° | 109.5° |
| C1 | C2 | H5 | 90.0° | 109.5° |
| C1 | C2 | H6 | 90.0° | 109.5° |
| C2 | C3 | C4 | 90.0° | 109.5° |
| C3 | C2 | H5 | 90.0° | 109.5° |
| C3 | C2 | H6 | 90.0° | 109.5° |
| C2 | C3 | H7 | 90.0° | 109.5° |
| C2 | C3 | H8 | 90.0° | 109.5° |
| C3 | C4 | C5 | 90.0° | 109.5° |
| C4 | C3 | H7 | 90.0° | 109.5° |
| C4 | C3 | H8 | 90.0° | 109.5° |
| C3 | C4 | H9 | 90.0° | 109.5° |
| C3 | C4 | H10 | 90.0° | 109.4° |
| C4 | C5 | C6 | 90.0° | 109.5° |
| C5 | C4 | H9 | 90.0° | 109.5° |
| C5 | C4 | H10 | 90.0° | 109.5° |
| C4 | C5 | H11 | 90.0° | 109.4° |
| C4 | C5 | H12 | 90.0° | 109.5° |
| C5 | C6 | C1 | 90.0° | 109.5° |
| C6 | C5 | H11 | 90.0° | 109.4° |
| C6 | C5 | H12 | 90.0° | 109.5° |
| C5 | C6 | H13 | 90.0° | 109.4° |
| C5 | C6 | H14 | 90.0° | 109.4° |
| C6 | C1 | H4 | 90.0° | 109.4° |
| C1 | C6 | H13 | 90.0° | 109.5° |
| C1 | C6 | H14 | 90.0° | 109.5° |
| H1 | C7 | H3 | 90.0° | 109.4° |
| H5 | C2 | H6 | 90.0° | 109.4° |
| H7 | C3 | H8 | 90.0° | 109.4° |
| H9 | C4 | H10 | 90.0° | 109.5° |
| H11 | C5 | H12 | 90.0° | 109.5° |
| H13 | C6 | H14 | 90.0° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O8 | C8 | O7 | OXT | 178.8° | 179.6° |
| O8 | C8 | OXT | H2 | 0.0° | 0.3° |
| O8 | C8 | O7 | C7 | 24.1° | 0.4° |
| O7 | C8 | OXT | H2 | 178.8° | 180.0° |
| C8 | O7 | C7 | C1 | 90.0° | 180.0° |
| C8 | O7 | C7 | H1 | 90.0° | 59.9° |
| C8 | O7 | C7 | H3 | 90.0° | 60.0° |
| OXT | C8 | O7 | C7 | 157.0° | 180.0° |
| O7 | C7 | C1 | H1 | 90.0° | 120.0° |
| O7 | C7 | C1 | H3 | 90.0° | 120.0° |
| O7 | C7 | C1 | C2 | 90.0° | 175.0° |
| O7 | C7 | C1 | C6 | 90.0° | 65.0° |
| O7 | C7 | H1 | H3 | 90.0° | 120.0° |
| O7 | C7 | C1 | H4 | 90.0° | 55.0° |
| C7 | C1 | C2 | C6 | 90.0° | 120.0° |
| C7 | C1 | C2 | H4 | 90.0° | 120.0° |
| C7 | C1 | C2 | C3 | 90.0° | 180.0° |
| C7 | C1 | C6 | C5 | 90.0° | 180.0° |
| C7 | C1 | C6 | H4 | 90.0° | 120.0° |
| C1 | C7 | H1 | H3 | 90.0° | 120.0° |
| C7 | C1 | C2 | H5 | 90.0° | 60.0° |
| C7 | C1 | C2 | H6 | 90.0° | 60.0° |
| C7 | C1 | C6 | H13 | 90.0° | 60.0° |
| C7 | C1 | C6 | H14 | 90.0° | 60.0° |
| C1 | C2 | C3 | H5 | 90.0° | 120.0° |
| C1 | C2 | C3 | H6 | 90.0° | 120.0° |
| C1 | C2 | C3 | C4 | 90.0° | 60.0° |
| C2 | C1 | C6 | C5 | 90.0° | 60.0° |
| C2 | C1 | C6 | H4 | 90.0° | 120.0° |
| C2 | C1 | C7 | H1 | 90.0° | 55.0° |
| C2 | C1 | C7 | H3 | 90.0° | 65.0° |
| C1 | C2 | H5 | H6 | 90.0° | 119.9° |
| C1 | C2 | C3 | H7 | 90.0° | 60.0° |
| C1 | C2 | C3 | H8 | 90.0° | 180.0° |
| C2 | C1 | C6 | H13 | 90.0° | 60.1° |
| C2 | C1 | C6 | H14 | 90.0° | 180.0° |
| C2 | C3 | C4 | H7 | 90.0° | 120.0° |
| C2 | C3 | C4 | H8 | 90.0° | 120.0° |
| C2 | C3 | C4 | C5 | 90.0° | 60.0° |
| C3 | C2 | C1 | C6 | 90.0° | 59.9° |
| C3 | C2 | C1 | H4 | 90.0° | 60.0° |
| C3 | C2 | H5 | H6 | 90.0° | 120.0° |
| C2 | C3 | H7 | H8 | 90.0° | 120.0° |
| C2 | C3 | C4 | H9 | 90.0° | 180.0° |
| C2 | C3 | C4 | H10 | 90.0° | 60.0° |
| C3 | C4 | C5 | H9 | 90.0° | 120.0° |
| C3 | C4 | C5 | H10 | 90.0° | 120.0° |
| C3 | C4 | C5 | C6 | 90.0° | 59.9° |
| C4 | C3 | C2 | H5 | 90.0° | 180.0° |
| C4 | C3 | C2 | H6 | 90.0° | 60.0° |
| C4 | C3 | H7 | H8 | 90.0° | 120.0° |
| C3 | C4 | H9 | H10 | 90.0° | 120.0° |
| C3 | C4 | C5 | H11 | 90.0° | 60.0° |
| C3 | C4 | C5 | H12 | 90.0° | 180.0° |
| C4 | C5 | C6 | H11 | 90.0° | 119.9° |
| C4 | C5 | C6 | H12 | 90.0° | 120.0° |
| C4 | C5 | C6 | C1 | 90.0° | 60.0° |
| C5 | C4 | C3 | H7 | 90.0° | 60.0° |
| C5 | C4 | C3 | H8 | 90.0° | 180.0° |
| C5 | C4 | H9 | H10 | 90.0° | 120.0° |
| C4 | C5 | H11 | H12 | 90.0° | 120.0° |
| C4 | C5 | C6 | H13 | 90.0° | 60.1° |
| C4 | C5 | C6 | H14 | 90.0° | 180.0° |
| C5 | C6 | C1 | H13 | 90.0° | 120.0° |
| C5 | C6 | C1 | H14 | 90.0° | 120.0° |
| C5 | C6 | C1 | H4 | 90.0° | 60.0° |
| C6 | C5 | C4 | H9 | 90.0° | 179.9° |
| C6 | C5 | C4 | H10 | 90.0° | 60.0° |
| C6 | C5 | H11 | H12 | 90.0° | 120.1° |
| C5 | C6 | H13 | H14 | 90.0° | 119.9° |
| C6 | C1 | C7 | H1 | 90.0° | 175.0° |
| C6 | C1 | C7 | H3 | 90.0° | 55.0° |
| C6 | C1 | C2 | H5 | 90.0° | 180.0° |
| C6 | C1 | C2 | H6 | 90.0° | 60.0° |
| C1 | C6 | C5 | H11 | 90.0° | 59.9° |
| C1 | C6 | C5 | H12 | 90.0° | 180.0° |
| C1 | C6 | H13 | H14 | 90.0° | 120.0° |
| H1 | C7 | C1 | H4 | 90.0° | 65.0° |
| H3 | C7 | C1 | H4 | 90.0° | 175.0° |
| H4 | C1 | C2 | H5 | 90.0° | 60.1° |
| H4 | C1 | C2 | H6 | 90.0° | 180.0° |
| H4 | C1 | C6 | H13 | 90.0° | 180.0° |
| H4 | C1 | C6 | H14 | 90.0° | 60.0° |
| H5 | C2 | C3 | H7 | 90.0° | 60.0° |
| H5 | C2 | C3 | H8 | 90.0° | 59.9° |
| H6 | C2 | C3 | H7 | 90.0° | 180.0° |
| H6 | C2 | C3 | H8 | 90.0° | 60.1° |
| H7 | C3 | C4 | H9 | 90.0° | 60.0° |
| H7 | C3 | C4 | H10 | 90.0° | 180.0° |
| H8 | C3 | C4 | H9 | 90.0° | 60.0° |
| H8 | C3 | C4 | H10 | 90.0° | 60.0° |
| H9 | C4 | C5 | H11 | 90.0° | 60.0° |
| H9 | C4 | C5 | H12 | 90.0° | 60.0° |
| H10 | C4 | C5 | H11 | 90.0° | 180.0° |
| H10 | C4 | C5 | H12 | 90.0° | 60.0° |
| H11 | C5 | C6 | H13 | 90.0° | NaN° |
| H11 | C5 | C6 | H14 | 90.0° | 60.1° |
| H12 | C5 | C6 | H13 | 90.0° | 59.9° |
| H12 | C5 | C6 | H14 | 90.0° | 60.0° |
