5HN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAB | CAH | doub | 1.21Å | 1.25Å | |
| OAA | CAH | sing | 1.35Å | 1.25Å | |
| CAH | CAJ | sing | 1.48Å | 1.39Å | |
| CAJ | CAE | doub | 1.40Å | 1.39Å | Aromatic |
| CAJ | CAF | sing | 1.40Å | 1.39Å | Aromatic |
| CAE | NAG | sing | 1.32Å | 1.40Å | Aromatic |
| CAF | CAI | doub | 1.39Å | 1.39Å | Aromatic |
| NAG | CAD | doub | 1.32Å | 1.40Å | Aromatic |
| CAI | CAD | sing | 1.39Å | 1.39Å | Aromatic |
| CAI | OAC | sing | 1.36Å | 1.36Å | |
| OAA | H1 | sing | 0.97Å | 0.95Å | |
| CAF | H2 | sing | 1.08Å | 1.08Å | |
| OAC | H3 | sing | 0.97Å | 0.95Å | |
| CAD | H4 | sing | 1.08Å | 1.08Å | |
| CAE | H5 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAB | CAH | OAA | 119.9° | 120.1° |
| OAB | CAH | CAJ | 120.0° | 120.0° |
| OAA | CAH | CAJ | 120.1° | 120.0° |
| CAH | OAA | H1 | 109.5° | 117.0° |
| CAH | CAJ | CAE | 119.7° | 120.5° |
| CAH | CAJ | CAF | 120.1° | 120.5° |
| CAE | CAJ | CAF | 120.1° | 119.0° |
| CAJ | CAE | NAG | 119.6° | 120.6° |
| CAJ | CAE | H5 | 120.2° | 119.7° |
| CAJ | CAF | CAI | 120.4° | 118.3° |
| CAJ | CAF | H2 | 119.8° | 120.8° |
| CAE | NAG | CAD | 120.0° | 122.0° |
| NAG | CAE | H5 | 120.2° | 119.7° |
| CAF | CAI | CAD | 120.0° | 119.2° |
| CAF | CAI | OAC | 120.1° | 120.4° |
| CAI | CAF | H2 | 119.8° | 120.9° |
| NAG | CAD | CAI | 119.8° | 121.0° |
| NAG | CAD | H4 | 120.1° | 119.5° |
| CAD | CAI | OAC | 119.9° | 120.4° |
| CAI | CAD | H4 | 120.1° | 119.5° |
| CAI | OAC | H3 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAB | CAH | OAA | CAJ | 178.5° | 179.9° |
| OAB | CAH | CAJ | CAE | 1.8° | 180.0° |
| OAB | CAH | CAJ | CAF | 177.4° | 0.4° |
| OAB | CAH | OAA | H1 | 0.0° | 0.0° |
| OAA | CAH | CAJ | CAE | 179.7° | 0.1° |
| OAA | CAH | CAJ | CAF | 1.1° | 179.7° |
| CAH | CAJ | CAE | CAF | 179.2° | 179.7° |
| CAH | CAJ | CAE | NAG | 179.6° | 179.7° |
| CAH | CAJ | CAF | CAI | 179.6° | 180.0° |
| CAJ | CAH | OAA | H1 | 178.5° | 180.0° |
| CAH | CAJ | CAF | H2 | 0.4° | 0.1° |
| CAH | CAJ | CAE | H5 | 0.5° | 0.0° |
| CAJ | CAE | NAG | H5 | 180.0° | 179.7° |
| CAE | CAJ | CAF | CAI | 0.4° | 0.3° |
| CAJ | CAE | NAG | CAD | 0.1° | 0.6° |
| CAE | CAJ | CAF | H2 | 179.6° | 179.7° |
| CAF | CAJ | CAE | NAG | 0.3° | 0.6° |
| CAJ | CAF | CAI | H2 | 180.0° | 180.0° |
| CAJ | CAF | CAI | CAD | 0.2° | 0.0° |
| CAJ | CAF | CAI | OAC | 179.8° | 180.0° |
| CAF | CAJ | CAE | H5 | 179.7° | 179.7° |
| CAE | NAG | CAD | CAI | 0.0° | 0.3° |
| CAE | NAG | CAD | H4 | 180.0° | 179.7° |
| CAF | CAI | CAD | NAG | 0.0° | 0.0° |
| CAF | CAI | CAD | OAC | 180.0° | 180.0° |
| CAF | CAI | OAC | H3 | 180.0° | 90.0° |
| CAF | CAI | CAD | H4 | 180.0° | 180.0° |
| NAG | CAD | CAI | H4 | 180.0° | 180.0° |
| NAG | CAD | CAI | OAC | 180.0° | 179.9° |
| CAD | NAG | CAE | H5 | 179.9° | 179.7° |
| CAD | CAI | CAF | H2 | 179.7° | 180.0° |
| CAD | CAI | OAC | H3 | 0.0° | 90.0° |
| OAC | CAI | CAF | H2 | 0.3° | 0.1° |
| OAC | CAI | CAD | H4 | 0.0° | 0.0° |
