NW7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.51Å | 1.50Å | |
| C3 | N1 | doub | 1.30Å | 1.30Å | Aromatic |
| C3 | C6 | sing | 1.47Å | 1.42Å | Aromatic |
| N1 | O1 | sing | 1.21Å | 1.41Å | Aromatic |
| O2 | C7 | doub | 1.22Å | 1.23Å | |
| C6 | C7 | sing | 1.47Å | 1.47Å | |
| C6 | C4 | doub | 1.37Å | 1.36Å | Aromatic |
| C7 | N2 | sing | 1.35Å | 1.37Å | |
| N3 | C8 | doub | 1.31Å | 1.31Å | Aromatic |
| N3 | O3 | sing | 1.21Å | 1.41Å | Aromatic |
| N2 | C8 | sing | 1.39Å | 1.40Å | |
| O1 | C4 | sing | 1.34Å | 1.33Å | Aromatic |
| C8 | C9 | sing | 1.42Å | 1.40Å | Aromatic |
| O3 | C10 | sing | 1.34Å | 1.35Å | Aromatic |
| C4 | C5 | sing | 1.51Å | 1.48Å | |
| C10 | C9 | doub | 1.35Å | 1.33Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.48Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.08Å | 1.08Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 114.6° | 109.5° |
| C2 | C1 | H4 | 109.5° | 109.5° |
| C2 | C1 | H5 | 109.5° | 109.4° |
| C2 | C1 | H6 | 109.5° | 109.4° |
| C1 | C2 | H10 | 108.2° | 109.4° |
| C1 | C2 | H11 | 108.2° | 109.4° |
| C2 | C3 | N1 | 120.9° | 127.4° |
| C2 | C3 | C6 | 128.8° | 127.3° |
| C3 | C2 | H10 | 108.2° | 109.5° |
| C3 | C2 | H11 | 108.2° | 109.5° |
| N1 | C3 | C6 | 110.4° | 105.3° |
| C3 | N1 | O1 | 106.3° | 112.4° |
| C3 | C6 | C7 | 129.6° | 128.5° |
| C3 | C6 | C4 | 105.3° | 102.8° |
| N1 | O1 | C4 | 108.8° | 113.2° |
| O2 | C7 | C6 | 120.8° | 120.0° |
| O2 | C7 | N2 | 123.1° | 120.0° |
| C7 | C6 | C4 | 125.1° | 128.6° |
| C6 | C7 | N2 | 116.1° | 120.0° |
| C6 | C4 | O1 | 109.3° | 106.3° |
| C6 | C4 | C5 | 134.6° | 126.8° |
| C7 | N2 | C8 | 125.5° | 120.0° |
| C7 | N2 | H13 | 117.2° | 120.0° |
| C8 | N3 | O3 | 105.6° | 111.4° |
| N3 | C8 | N2 | 122.0° | 126.9° |
| N3 | C8 | C9 | 111.0° | 106.2° |
| N3 | O3 | C10 | 108.2° | 111.8° |
| N2 | C8 | C9 | 127.0° | 126.9° |
| C8 | N2 | H13 | 117.3° | 120.0° |
| O1 | C4 | C5 | 116.1° | 126.9° |
| C8 | C9 | C10 | 105.8° | 104.0° |
| C8 | C9 | H12 | 127.1° | 128.0° |
| O3 | C10 | C9 | 109.4° | 106.6° |
| O3 | C10 | C11 | 115.7° | 126.7° |
| C4 | C5 | H1 | 109.5° | 109.4° |
| C4 | C5 | H2 | 109.5° | 109.5° |
| C4 | C5 | H3 | 109.5° | 109.5° |
| C9 | C10 | C11 | 134.9° | 126.7° |
| C10 | C9 | H12 | 127.1° | 128.0° |
| C10 | C11 | H7 | 109.5° | 109.4° |
| C10 | C11 | H8 | 109.5° | 109.5° |
| C10 | C11 | H9 | 109.5° | 109.5° |
| H1 | C5 | H2 | 109.4° | 109.5° |
| H1 | C5 | H3 | 109.5° | 109.5° |
| H2 | C5 | H3 | 109.5° | 109.5° |
| H4 | C1 | H5 | 109.5° | 109.5° |
| H4 | C1 | H6 | 109.5° | 109.5° |
| H5 | C1 | H6 | 109.5° | 109.5° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H7 | C11 | H9 | 109.4° | 109.4° |
| H8 | C11 | H9 | 109.5° | 109.5° |
| H10 | C2 | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H10 | 120.7° | 120.0° |
| C1 | C2 | C3 | H11 | 120.7° | 120.0° |
| C1 | C2 | C3 | N1 | 18.9° | 90.0° |
| C1 | C2 | C3 | C6 | 160.9° | 90.0° |
| C2 | C1 | H4 | H5 | 120.0° | 119.9° |
| C2 | C1 | H4 | H6 | 120.0° | 120.0° |
| C2 | C1 | H5 | H6 | 120.0° | 120.0° |
| C1 | C2 | H10 | H11 | 117.6° | 120.0° |
| C2 | C3 | N1 | C6 | 179.8° | 180.0° |
| C2 | C3 | N1 | O1 | 179.5° | 180.0° |
| C2 | C3 | C6 | C7 | 0.6° | 0.0° |
| C2 | C3 | C6 | C4 | 180.0° | 180.0° |
| C3 | C2 | C1 | H4 | 180.0° | 59.9° |
| C3 | C2 | C1 | H5 | 60.0° | 60.0° |
| C3 | C2 | C1 | H6 | 60.0° | 180.0° |
| C3 | C2 | H10 | H11 | 117.7° | 120.1° |
| N1 | C3 | C6 | C7 | 179.6° | 180.0° |
| N1 | C3 | C6 | C4 | 0.2° | 0.0° |
| C3 | N1 | O1 | C4 | 0.8° | 0.1° |
| N1 | C3 | C2 | H10 | 101.9° | 30.0° |
| N1 | C3 | C2 | H11 | 139.6° | 150.0° |
| C6 | C3 | N1 | O1 | 0.3° | 0.1° |
| C3 | C6 | C7 | O2 | 127.5° | 90.0° |
| C3 | C6 | C7 | C4 | 179.2° | 179.9° |
| C3 | C6 | C7 | N2 | 53.3° | 90.1° |
| C3 | C6 | C4 | O1 | 0.7° | 0.0° |
| C3 | C6 | C4 | C5 | 179.7° | 180.0° |
| C6 | C3 | C2 | H10 | 78.3° | 150.0° |
| C6 | C3 | C2 | H11 | 40.2° | 30.0° |
| N1 | O1 | C4 | C6 | 0.9° | 0.0° |
| N1 | O1 | C4 | C5 | 179.4° | 180.0° |
| O2 | C7 | C6 | N2 | 179.2° | 179.9° |
| O2 | C7 | C6 | C4 | 51.7° | 89.9° |
| O2 | C7 | N2 | C8 | 7.3° | 0.1° |
| O2 | C7 | N2 | H13 | 172.7° | 180.0° |
| C6 | C7 | N2 | C8 | 171.9° | 180.0° |
| C7 | C6 | C4 | O1 | 179.9° | 179.9° |
| C7 | C6 | C4 | C5 | 0.3° | 0.0° |
| C6 | C7 | N2 | H13 | 8.1° | 0.1° |
| C4 | C6 | C7 | N2 | 127.5° | 90.0° |
| C6 | C4 | O1 | C5 | 179.7° | 180.0° |
| C6 | C4 | C5 | H1 | 179.6° | 90.0° |
| C6 | C4 | C5 | H2 | 60.4° | 150.0° |
| C6 | C4 | C5 | H3 | 59.6° | 30.0° |
| C7 | N2 | C8 | N3 | 31.3° | 180.0° |
| C7 | N2 | C8 | H13 | 180.0° | 179.9° |
| C7 | N2 | C8 | C9 | 148.2° | 0.1° |
| N3 | C8 | N2 | C9 | 179.5° | 179.9° |
| C8 | N3 | O3 | C10 | 0.3° | 0.0° |
| N3 | C8 | C9 | C10 | 0.1° | 0.0° |
| N3 | C8 | C9 | H12 | 179.9° | 179.9° |
| N3 | C8 | N2 | H13 | 148.7° | 0.1° |
| O3 | N3 | C8 | N2 | 179.5° | 179.9° |
| O3 | N3 | C8 | C9 | 0.1° | 0.0° |
| N3 | O3 | C10 | C9 | 0.4° | 0.0° |
| N3 | O3 | C10 | C11 | 179.8° | 180.0° |
| N2 | C8 | C9 | C10 | 179.7° | 179.9° |
| N2 | C8 | C9 | H12 | 0.3° | 0.0° |
| O1 | C4 | C5 | H1 | 0.0° | 90.0° |
| O1 | C4 | C5 | H2 | 120.0° | 29.9° |
| O1 | C4 | C5 | H3 | 120.0° | 150.0° |
| C8 | C9 | C10 | O3 | 0.3° | 0.0° |
| C8 | C9 | C10 | H12 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 179.9° | 180.0° |
| C9 | C8 | N2 | H13 | 31.8° | 180.0° |
| O3 | C10 | C9 | C11 | 179.8° | 180.0° |
| O3 | C10 | C11 | H7 | 0.0° | 90.0° |
| O3 | C10 | C11 | H8 | 120.0° | 30.0° |
| O3 | C10 | C11 | H9 | 120.0° | 150.1° |
| O3 | C10 | C9 | H12 | 179.7° | 179.9° |
| C4 | C5 | H1 | H2 | 120.0° | 120.0° |
| C4 | C5 | H1 | H3 | 120.0° | 119.9° |
| C4 | C5 | H2 | H3 | 120.0° | 120.0° |
| C9 | C10 | C11 | H7 | 179.8° | 90.0° |
| C9 | C10 | C11 | H8 | 60.2° | 150.0° |
| C9 | C10 | C11 | H9 | 59.8° | 30.0° |
| C10 | C11 | H7 | H8 | 120.0° | 120.0° |
| C10 | C11 | H7 | H9 | 120.0° | 120.0° |
| C10 | C11 | H8 | H9 | 120.0° | 120.1° |
| C11 | C10 | C9 | H12 | 0.1° | 0.1° |
| H1 | C5 | H2 | H3 | 120.0° | 120.1° |
| H4 | C1 | H5 | H6 | 120.0° | 120.1° |
| H4 | C1 | C2 | H10 | 59.2° | 60.0° |
| H4 | C1 | C2 | H11 | 59.3° | 180.0° |
| H5 | C1 | C2 | H10 | 60.8° | 180.0° |
| H5 | C1 | C2 | H11 | 179.3° | 60.0° |
| H6 | C1 | C2 | H10 | 179.2° | 60.1° |
| H6 | C1 | C2 | H11 | 60.7° | 59.9° |
| H7 | C11 | H8 | H9 | 120.0° | 120.0° |
