AAC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | O1 | sing | 1.34Å | 1.27Å | |
| C1 | O2 | doub | 1.21Å | 1.28Å | |
| C2 | N1 | sing | 1.46Å | 1.40Å | |
| C2 | HC21 | sing | 1.09Å | 1.11Å | |
| C2 | HC22 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.51Å | 1.51Å | |
| C3 | N1 | sing | 1.35Å | 1.32Å | |
| C3 | O3 | doub | 1.21Å | 1.22Å | |
| C4 | HC41 | sing | 1.09Å | 1.11Å | |
| C4 | HC42 | sing | 1.09Å | 1.12Å | |
| C4 | HC43 | sing | 1.09Å | 1.12Å | |
| N1 | HN1 | sing | 0.97Å | 1.02Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O1 | 118.2° | 120.1° |
| C2 | C1 | O2 | 118.6° | 119.9° |
| C1 | C2 | N1 | 115.4° | 109.5° |
| C1 | C2 | HC21 | 110.1° | 109.4° |
| C1 | C2 | HC22 | 110.1° | 109.4° |
| O1 | C1 | O2 | 123.2° | 120.0° |
| C1 | O1 | HO1 | 118.1° | 120.0° |
| N1 | C2 | HC21 | 110.1° | 109.5° |
| N1 | C2 | HC22 | 110.1° | 109.5° |
| C2 | N1 | C3 | 126.3° | 120.0° |
| C2 | N1 | HN1 | 120.2° | 120.0° |
| HC21 | C2 | HC22 | 100.2° | 109.5° |
| C4 | C3 | N1 | 117.3° | 120.1° |
| C4 | C3 | O3 | 122.0° | 120.0° |
| C3 | C4 | HC41 | 117.3° | 109.5° |
| C3 | C4 | HC42 | 109.3° | 109.4° |
| C3 | C4 | HC43 | 109.4° | 109.4° |
| N1 | C3 | O3 | 120.6° | 119.9° |
| C3 | N1 | HN1 | 113.5° | 120.0° |
| HC41 | C4 | HC42 | 109.4° | 109.5° |
| HC41 | C4 | HC43 | 109.4° | 109.5° |
| HC42 | C4 | HC43 | 100.7° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O1 | O2 | 180.0° | 180.0° |
| C1 | C2 | N1 | HC21 | 125.3° | 119.9° |
| C1 | C2 | N1 | HC22 | 125.2° | 119.9° |
| C1 | C2 | HC21 | HC22 | 115.9° | 119.9° |
| C1 | C2 | N1 | C3 | 116.4° | 180.0° |
| C1 | C2 | N1 | HN1 | 63.6° | 0.0° |
| C2 | C1 | O1 | HO1 | 180.0° | 180.0° |
| O1 | C1 | C2 | N1 | 155.0° | 180.0° |
| O1 | C1 | C2 | HC21 | 29.7° | 60.0° |
| O1 | C1 | C2 | HC22 | 79.8° | 60.0° |
| O2 | C1 | C2 | N1 | 25.1° | 0.0° |
| O2 | C1 | C2 | HC21 | 150.3° | 120.0° |
| O2 | C1 | C2 | HC22 | 100.2° | 120.0° |
| O2 | C1 | O1 | HO1 | 0.0° | 0.0° |
| N1 | C2 | HC21 | HC22 | 115.9° | 120.1° |
| C2 | N1 | C3 | C4 | 175.8° | 180.0° |
| C2 | N1 | C3 | HN1 | 180.0° | 180.0° |
| C2 | N1 | C3 | O3 | 0.2° | 0.0° |
| HC21 | C2 | N1 | C3 | 8.9° | 60.1° |
| HC21 | C2 | N1 | HN1 | 171.1° | 119.9° |
| HC22 | C2 | N1 | C3 | 118.4° | 60.1° |
| HC22 | C2 | N1 | HN1 | 61.6° | 119.9° |
| C4 | C3 | N1 | O3 | 175.9° | 180.0° |
| C3 | C4 | HC41 | HC42 | 125.3° | 120.0° |
| C3 | C4 | HC41 | HC43 | 125.2° | 120.0° |
| C3 | C4 | HC42 | HC43 | 115.1° | 119.9° |
| C4 | C3 | N1 | HN1 | 4.2° | 0.0° |
| N1 | C3 | C4 | HC41 | 180.0° | 180.0° |
| N1 | C3 | C4 | HC42 | 54.7° | 60.0° |
| N1 | C3 | C4 | HC43 | 54.7° | 60.0° |
| O3 | C3 | C4 | HC41 | 4.2° | 0.0° |
| O3 | C3 | C4 | HC42 | 121.2° | 120.0° |
| O3 | C3 | C4 | HC43 | 129.4° | 120.0° |
| O3 | C3 | N1 | HN1 | 179.8° | 180.0° |
| HC41 | C4 | HC42 | HC43 | 115.2° | 120.0° |
