1N2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAD | CAN | doub | 1.21Å | 1.23Å | |
| CAN | CAH | sing | 1.51Å | 1.37Å | |
| CAN | NAP | sing | 1.34Å | 1.36Å | |
| CAH | CAG | sing | 1.54Å | 1.55Å | |
| NAP | CAJ | sing | 1.47Å | 1.49Å | |
| NAP | CAM | sing | 1.34Å | 1.34Å | |
| CAJ | CAI | sing | 1.53Å | 1.56Å | |
| CAG | CAM | sing | 1.51Å | 1.34Å | |
| CAM | OAC | doub | 1.21Å | 1.22Å | |
| OAB | CAL | doub | 1.21Å | 1.23Å | |
| CAI | NAO | sing | 1.46Å | 1.41Å | |
| CAL | NAO | sing | 1.34Å | 1.33Å | |
| CAL | CAF | sing | 1.51Å | 1.39Å | |
| NAO | CAK | sing | 1.34Å | 1.34Å | |
| CAF | CAE | sing | 1.54Å | 1.51Å | |
| CAK | OAA | doub | 1.21Å | 1.22Å | |
| CAK | CAE | sing | 1.51Å | 1.38Å | |
| CAE | H1 | sing | 1.09Å | 1.10Å | |
| CAF | H2 | sing | 1.09Å | 1.10Å | |
| CAI | H3 | sing | 1.09Å | 1.10Å | |
| CAI | H4 | sing | 1.09Å | 1.10Å | |
| CAJ | H5 | sing | 1.09Å | 1.10Å | |
| CAJ | H6 | sing | 1.09Å | 1.10Å | |
| CAG | H7 | sing | 1.09Å | 1.10Å | |
| CAH | H8 | sing | 1.09Å | 1.10Å | |
| CAE | H9 | sing | 1.09Å | 1.10Å | |
| CAF | H10 | sing | 1.09Å | 1.10Å | |
| CAG | H11 | sing | 1.09Å | 1.10Å | |
| CAH | H12 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAD | CAN | CAH | 120.6° | 125.4° |
| OAD | CAN | NAP | 129.3° | 125.4° |
| CAH | CAN | NAP | 110.0° | 109.2° |
| CAN | CAH | CAG | 105.1° | 103.5° |
| CAN | CAH | H8 | 110.6° | 110.8° |
| CAN | CAH | H12 | 110.6° | 110.5° |
| CAN | NAP | CAJ | 129.0° | 122.8° |
| CAN | NAP | CAM | 108.3° | 114.5° |
| CAH | CAG | CAM | 102.2° | 103.6° |
| CAH | CAG | H7 | 111.3° | 110.6° |
| CAG | CAH | H8 | 110.5° | 110.6° |
| CAH | CAG | H11 | 111.2° | 110.7° |
| CAG | CAH | H12 | 110.5° | 110.6° |
| CAJ | NAP | CAM | 122.7° | 122.7° |
| NAP | CAJ | CAI | 114.8° | 109.5° |
| NAP | CAJ | H5 | 108.1° | 109.5° |
| NAP | CAJ | H6 | 108.1° | 109.5° |
| NAP | CAM | CAG | 114.3° | 109.2° |
| NAP | CAM | OAC | 125.8° | 125.4° |
| CAJ | CAI | NAO | 110.0° | 109.5° |
| CAJ | CAI | H3 | 109.3° | 109.5° |
| CAJ | CAI | H4 | 109.3° | 109.5° |
| CAI | CAJ | H5 | 108.1° | 109.5° |
| CAI | CAJ | H6 | 108.1° | 109.5° |
| CAG | CAM | OAC | 119.9° | 125.4° |
| CAM | CAG | H7 | 111.2° | 110.6° |
| CAM | CAG | H11 | 111.2° | 110.6° |
| OAB | CAL | NAO | 124.8° | 125.4° |
| OAB | CAL | CAF | 123.4° | 125.4° |
| CAI | NAO | CAL | 126.6° | 122.8° |
| CAI | NAO | CAK | 125.3° | 122.8° |
| NAO | CAI | H3 | 109.3° | 109.5° |
| NAO | CAI | H4 | 109.4° | 109.5° |
| NAO | CAL | CAF | 111.7° | 109.2° |
| CAL | NAO | CAK | 108.1° | 114.5° |
| CAL | CAF | CAE | 104.7° | 103.6° |
| CAL | CAF | H2 | 110.7° | 110.7° |
| CAL | CAF | H10 | 110.6° | 110.7° |
| NAO | CAK | OAA | 124.6° | 125.4° |
| NAO | CAK | CAE | 113.3° | 109.2° |
| CAF | CAE | CAK | 102.1° | 103.6° |
| CAF | CAE | H1 | 111.3° | 110.6° |
| CAE | CAF | H2 | 110.6° | 110.6° |
| CAF | CAE | H9 | 111.3° | 110.8° |
| CAE | CAF | H10 | 110.7° | 110.6° |
| OAA | CAK | CAE | 122.2° | 125.4° |
| CAK | CAE | H1 | 111.3° | 110.6° |
| CAK | CAE | H9 | 111.3° | 110.6° |
| H1 | CAE | H9 | 109.4° | 110.5° |
| H2 | CAF | H10 | 109.5° | 110.5° |
| H3 | CAI | H4 | 109.4° | 109.5° |
| H5 | CAJ | H6 | 109.5° | 109.5° |
| H7 | CAG | H11 | 109.5° | 110.6° |
| H8 | CAH | H12 | 109.5° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAD | CAN | CAH | NAP | 178.4° | 179.6° |
| OAD | CAN | CAH | CAG | 179.6° | 180.0° |
| OAD | CAN | NAP | CAJ | 1.2° | 0.2° |
| OAD | CAN | NAP | CAM | 178.2° | 179.9° |
| OAD | CAN | CAH | H8 | 61.1° | 61.4° |
| OAD | CAN | CAH | H12 | 60.3° | 61.5° |
| CAN | CAH | CAG | H8 | 119.3° | 118.7° |
| CAN | CAH | CAG | H12 | 119.3° | 118.4° |
| CAH | CAN | NAP | CAJ | 177.1° | 179.8° |
| CAH | CAN | NAP | CAM | 0.0° | 0.4° |
| CAN | CAH | CAG | CAM | 1.8° | 0.2° |
| CAN | CAH | CAG | H7 | 117.0° | 118.7° |
| CAN | CAH | H8 | H12 | 122.1° | 122.9° |
| CAN | CAH | CAG | H11 | 120.7° | 118.3° |
| NAP | CAN | CAH | CAG | 1.1° | 0.4° |
| CAN | NAP | CAJ | CAM | 176.6° | 179.7° |
| CAN | NAP | CAJ | CAI | 158.2° | 90.3° |
| CAN | NAP | CAM | CAG | 1.4° | 0.3° |
| CAN | NAP | CAM | OAC | 178.1° | 179.7° |
| CAN | NAP | CAJ | H5 | 81.1° | 149.7° |
| CAN | NAP | CAJ | H6 | 37.4° | 29.7° |
| NAP | CAN | CAH | H8 | 120.4° | 118.2° |
| NAP | CAN | CAH | H12 | 118.2° | 118.9° |
| CAH | CAG | CAM | NAP | 2.0° | 0.0° |
| CAH | CAG | CAM | H7 | 118.8° | 118.5° |
| CAH | CAG | CAM | H11 | 118.8° | 118.7° |
| CAH | CAG | CAM | OAC | 177.6° | 180.0° |
| CAH | CAG | H7 | H11 | 123.4° | 123.0° |
| CAG | CAH | H8 | H12 | 122.0° | 122.9° |
| NAP | CAJ | CAI | H5 | 120.8° | 120.0° |
| NAP | CAJ | CAI | H6 | 120.7° | 120.0° |
| CAJ | NAP | CAM | CAG | 178.7° | 180.0° |
| CAJ | NAP | CAM | OAC | 0.9° | 0.0° |
| NAP | CAJ | CAI | NAO | 141.4° | 180.0° |
| NAP | CAJ | CAI | H3 | 98.6° | 60.0° |
| NAP | CAJ | CAI | H4 | 21.3° | 60.0° |
| NAP | CAJ | H5 | H6 | 117.6° | 120.0° |
| CAM | NAP | CAJ | CAI | 25.2° | 90.0° |
| NAP | CAM | CAG | OAC | 179.6° | 180.0° |
| CAM | NAP | CAJ | H5 | 95.6° | 30.0° |
| CAM | NAP | CAJ | H6 | 145.9° | 150.0° |
| NAP | CAM | CAG | H7 | 116.9° | 118.5° |
| NAP | CAM | CAG | H11 | 120.8° | 118.7° |
| CAJ | CAI | NAO | H3 | 120.1° | 120.0° |
| CAJ | CAI | NAO | H4 | 120.1° | 120.0° |
| CAJ | CAI | NAO | CAL | 34.8° | 90.0° |
| CAJ | CAI | NAO | CAK | 146.8° | 90.5° |
| CAJ | CAI | H3 | H4 | 119.7° | 120.0° |
| CAI | CAJ | H5 | H6 | 117.6° | 120.0° |
| CAM | CAG | H7 | H11 | 123.3° | 122.8° |
| CAM | CAG | CAH | H8 | 121.1° | 118.5° |
| CAM | CAG | CAH | H12 | 117.5° | 118.6° |
| OAC | CAM | CAG | H7 | 63.6° | 61.5° |
| OAC | CAM | CAG | H11 | 58.7° | 61.4° |
| OAB | CAL | NAO | CAI | 1.7° | 0.4° |
| OAB | CAL | NAO | CAF | 177.0° | 179.6° |
| OAB | CAL | NAO | CAK | 179.7° | 180.0° |
| OAB | CAL | CAF | CAE | 178.9° | 179.8° |
| OAB | CAL | CAF | H2 | 61.9° | 61.6° |
| OAB | CAL | CAF | H10 | 59.6° | 61.3° |
| CAI | NAO | CAL | CAK | 178.7° | 179.5° |
| CAI | NAO | CAL | CAF | 178.6° | 180.0° |
| CAI | NAO | CAK | OAA | 2.3° | 0.3° |
| CAI | NAO | CAK | CAE | 178.6° | 180.0° |
| NAO | CAI | H3 | H4 | 119.7° | 120.0° |
| NAO | CAI | CAJ | H5 | 20.6° | 60.0° |
| NAO | CAI | CAJ | H6 | 97.9° | 60.0° |
| NAO | CAL | CAF | CAE | 4.1° | 0.2° |
| CAL | NAO | CAK | OAA | 179.0° | 179.8° |
| CAL | NAO | CAK | CAE | 0.1° | 0.4° |
| NAO | CAL | CAF | H2 | 115.1° | 118.7° |
| CAL | NAO | CAI | H3 | 85.3° | 150.0° |
| CAL | NAO | CAI | H4 | 154.9° | 30.0° |
| NAO | CAL | CAF | H10 | 123.4° | 118.4° |
| CAF | CAL | NAO | CAK | 2.7° | 0.4° |
| CAL | CAF | CAE | H2 | 119.2° | 118.6° |
| CAL | CAF | CAE | H10 | 119.2° | 118.6° |
| CAL | CAF | CAE | CAK | 3.8° | 0.1° |
| CAL | CAF | CAE | H1 | 122.6° | 118.6° |
| CAL | CAF | H2 | H10 | 122.2° | 123.0° |
| CAL | CAF | CAE | H9 | 115.0° | 118.6° |
| NAO | CAK | CAE | CAF | 2.5° | 0.3° |
| NAO | CAK | OAA | CAE | 179.0° | 179.7° |
| NAO | CAK | CAE | H1 | 121.3° | 118.8° |
| CAK | NAO | CAI | H3 | 93.1° | 29.5° |
| CAK | NAO | CAI | H4 | 26.7° | 149.5° |
| NAO | CAK | CAE | H9 | 116.4° | 118.4° |
| CAF | CAE | CAK | OAA | 176.7° | 180.0° |
| CAF | CAE | CAK | H1 | 118.8° | 118.5° |
| CAF | CAE | CAK | H9 | 118.8° | 118.7° |
| CAF | CAE | H1 | H9 | 123.4° | 123.0° |
| CAE | CAF | H2 | H10 | 122.2° | 122.8° |
| OAA | CAK | CAE | H1 | 57.8° | 61.5° |
| OAA | CAK | CAE | H9 | 64.5° | 61.3° |
| CAK | CAE | H1 | H9 | 123.4° | 122.9° |
| CAK | CAE | CAF | H2 | 115.4° | 118.5° |
| CAK | CAE | CAF | H10 | 123.0° | 118.7° |
| H1 | CAE | CAF | H2 | 3.4° | 0.1° |
| H1 | CAE | CAF | H10 | 118.1° | 122.8° |
| H2 | CAF | CAE | H9 | 125.7° | 122.8° |
| H3 | CAI | CAJ | H5 | 140.7° | 180.0° |
| H3 | CAI | CAJ | H6 | 22.2° | 60.0° |
| H4 | CAI | CAJ | H5 | 99.5° | 60.0° |
| H4 | CAI | CAJ | H6 | 142.0° | 180.0° |
| H7 | CAG | CAH | H8 | 2.3° | 0.0° |
| H7 | CAG | CAH | H12 | 123.7° | 122.9° |
| H8 | CAH | CAG | H11 | 120.0° | 122.9° |
| H9 | CAE | CAF | H10 | 4.2° | 0.1° |
| H11 | CAG | CAH | H12 | 1.3° | 0.0° |
