SY8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C4 | N | sing | 1.47Å | 1.47Å | |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| C | C1 | sing | 1.51Å | 1.50Å | |
| C1 | O | doub | 1.21Å | 1.22Å | |
| N | H1 | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| C | H5 | sing | 1.09Å | 1.10Å | |
| C | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| C3 | H10 | sing | 1.09Å | 1.10Å | |
| C4 | H11 | sing | 1.09Å | 1.10Å | |
| C4 | H12 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C3 | C2 | 113.7° | 109.5° |
| C3 | C4 | N | 109.9° | 109.5° |
| C4 | C3 | H9 | 108.4° | 109.5° |
| C4 | C3 | H10 | 108.4° | 109.5° |
| C3 | C4 | H11 | 109.3° | 109.5° |
| C3 | C4 | H12 | 109.3° | 109.5° |
| C3 | C2 | C1 | 112.5° | 109.5° |
| C3 | C2 | H7 | 108.7° | 109.5° |
| C3 | C2 | H8 | 108.7° | 109.5° |
| C2 | C3 | H9 | 108.4° | 109.5° |
| C2 | C3 | H10 | 108.4° | 109.5° |
| C4 | N | H1 | 109.5° | 111.0° |
| C4 | N | H2 | 109.4° | 111.0° |
| N | C4 | H11 | 109.3° | 109.4° |
| N | C4 | H12 | 109.4° | 109.4° |
| C2 | C1 | C | 120.2° | 120.0° |
| C2 | C1 | O | 118.6° | 120.0° |
| C1 | C2 | H7 | 108.7° | 109.4° |
| C1 | C2 | H8 | 108.7° | 109.5° |
| C | C1 | O | 121.2° | 120.0° |
| C1 | C | H4 | 109.5° | 109.5° |
| C1 | C | H5 | 109.5° | 109.4° |
| C1 | C | H6 | 109.5° | 109.5° |
| H1 | N | H2 | 109.5° | 111.0° |
| H4 | C | H5 | 109.4° | 109.4° |
| H4 | C | H6 | 109.5° | 109.5° |
| H5 | C | H6 | 109.5° | 109.4° |
| H7 | C2 | H8 | 109.5° | 109.5° |
| H9 | C3 | H10 | 109.4° | 109.5° |
| H11 | C4 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C3 | C2 | H9 | 120.6° | 120.0° |
| C4 | C3 | C2 | H10 | 120.6° | 120.0° |
| C3 | C4 | N | H11 | 120.0° | 120.0° |
| C3 | C4 | N | H12 | 120.0° | 120.0° |
| C4 | C3 | C2 | C1 | 54.8° | 180.0° |
| C3 | C4 | N | H1 | 180.0° | 180.0° |
| C3 | C4 | N | H2 | 60.0° | 56.0° |
| C4 | C3 | C2 | H7 | 175.3° | 60.0° |
| C4 | C3 | C2 | H8 | 65.6° | 60.0° |
| C4 | C3 | H9 | H10 | 118.1° | 120.0° |
| C3 | C4 | H11 | H12 | 119.8° | 120.1° |
| C2 | C3 | C4 | N | 55.1° | 180.0° |
| C3 | C2 | C1 | H7 | 120.5° | 120.0° |
| C3 | C2 | C1 | H8 | 120.4° | 120.0° |
| C3 | C2 | C1 | C | 47.6° | 180.0° |
| C3 | C2 | C1 | O | 133.2° | 0.0° |
| C3 | C2 | H7 | H8 | 118.6° | 120.0° |
| C2 | C3 | H9 | H10 | 118.1° | 120.0° |
| C2 | C3 | C4 | H11 | 175.1° | 60.0° |
| C2 | C3 | C4 | H12 | 64.9° | 60.1° |
| C4 | N | H1 | H2 | 120.0° | 124.0° |
| N | C4 | C3 | H9 | 175.7° | 60.0° |
| N | C4 | C3 | H10 | 65.5° | 60.0° |
| N | C4 | H11 | H12 | 119.8° | 119.9° |
| C2 | C1 | C | O | 179.2° | 180.0° |
| C2 | C1 | C | H4 | 179.2° | 89.9° |
| C2 | C1 | C | H5 | 60.8° | 30.0° |
| C2 | C1 | C | H6 | 59.2° | 150.0° |
| C1 | C2 | H7 | H8 | 118.6° | 120.0° |
| C1 | C2 | C3 | H9 | 65.8° | 60.0° |
| C1 | C2 | C3 | H10 | 175.5° | 60.0° |
| C1 | C | H4 | H5 | 120.0° | 120.0° |
| C1 | C | H4 | H6 | 120.0° | 120.1° |
| C1 | C | H5 | H6 | 120.0° | 120.0° |
| C | C1 | C2 | H7 | 72.9° | 60.0° |
| C | C1 | C2 | H8 | 168.0° | 60.0° |
| O | C1 | C | H4 | 0.0° | 90.1° |
| O | C1 | C | H5 | 120.0° | 150.0° |
| O | C1 | C | H6 | 120.0° | 30.0° |
| O | C1 | C2 | H7 | 106.3° | 120.0° |
| O | C1 | C2 | H8 | 12.8° | 120.0° |
| H1 | N | C4 | H11 | 60.0° | 60.0° |
| H1 | N | C4 | H12 | 60.0° | 60.0° |
| H2 | N | C4 | H11 | 179.9° | 64.0° |
| H2 | N | C4 | H12 | 60.0° | 176.0° |
| H4 | C | H5 | H6 | 120.0° | 120.0° |
| H7 | C2 | C3 | H9 | 54.7° | 179.9° |
| H7 | C2 | C3 | H10 | 64.1° | 59.9° |
| H8 | C2 | C3 | H9 | 173.7° | 60.0° |
| H8 | C2 | C3 | H10 | 55.0° | 180.0° |
| H9 | C3 | C4 | H11 | 64.2° | 60.0° |
| H9 | C3 | C4 | H12 | 55.7° | 180.0° |
| H10 | C3 | C4 | H11 | 54.5° | 180.0° |
| H10 | C3 | C4 | H12 | 174.4° | 60.0° |
