NR4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | CAL | sing | 1.43Å | 1.46Å | |
| OAB | CAM | sing | 1.43Å | 1.42Å | |
| OAC | CAQ | sing | 1.43Å | 1.43Å | |
| OAD | CAR | sing | 1.43Å | 1.47Å | |
| OAE | CAS | sing | 1.43Å | 1.42Å | |
| OAF | CAT | sing | 1.43Å | 1.42Å | |
| OAG | CAU | sing | 1.43Å | 1.44Å | |
| OAH | CAV | sing | 1.43Å | 1.42Å | |
| OAI | SAZ | sing | 1.45Å | 1.48Å | |
| OAJ | SAZ | doub | 1.46Å | 1.47Å | |
| OAK | SAZ | doub | 1.45Å | 1.46Å | |
| CAL | CAQ | sing | 1.53Å | 1.53Å | |
| CAM | CAW | sing | 1.53Å | 1.55Å | |
| CAN | CAR | sing | 1.55Å | 1.54Å | |
| CAN | SAY | sing | 1.84Å | 1.88Å | |
| CAO | CAS | sing | 1.53Å | 1.51Å | |
| CAO | SAY | sing | 1.81Å | 1.79Å | |
| OAP | CAX | sing | 1.43Å | 1.45Å | |
| OAP | SAZ | sing | 1.52Å | 1.48Å | |
| CAQ | CAT | sing | 1.53Å | 1.50Å | |
| CAR | CAU | sing | 1.53Å | 1.54Å | |
| CAS | CAX | sing | 1.53Å | 1.51Å | |
| CAT | CAV | sing | 1.53Å | 1.50Å | |
| CAU | CAW | sing | 1.54Å | 1.55Å | |
| CAV | CAX | sing | 1.53Å | 1.50Å | |
| CAW | SAY | sing | 1.83Å | 1.82Å | |
| OAA | HOAA | sing | 0.97Å | 0.95Å | |
| OAB | HOAB | sing | 0.97Å | 0.95Å | |
| OAC | HOAC | sing | 0.97Å | 0.95Å | |
| OAD | HOAD | sing | 0.97Å | 0.95Å | |
| OAE | HOAE | sing | 0.97Å | 0.95Å | |
| OAF | HOAF | sing | 0.97Å | 0.95Å | |
| OAG | HOAG | sing | 0.97Å | 0.95Å | |
| OAH | HOAH | sing | 0.97Å | 0.95Å | |
| CAL | HAL | sing | 1.09Å | 1.10Å | |
| CAL | HALA | sing | 1.09Å | 1.10Å | |
| CAM | HAM | sing | 1.09Å | 1.10Å | |
| CAM | HAMA | sing | 1.09Å | 1.10Å | |
| CAN | HAN | sing | 1.09Å | 1.10Å | |
| CAN | HANA | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.09Å | 1.10Å | |
| CAO | HAOA | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ | sing | 1.09Å | 1.10Å | |
| CAR | HAR | sing | 1.09Å | 1.10Å | |
| CAS | HAS | sing | 1.09Å | 1.10Å | |
| CAT | HAT | sing | 1.09Å | 1.10Å | |
| CAU | HAU | sing | 1.09Å | 1.10Å | |
| CAV | HAV | sing | 1.09Å | 1.10Å | |
| CAW | HAW | sing | 1.09Å | 1.10Å | |
| CAX | HAX | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | CAL | CAQ | 108.9° | 109.5° |
| CAL | OAA | HOAA | 109.5° | 114.0° |
| OAA | CAL | HAL | 109.7° | 109.5° |
| OAA | CAL | HALA | 109.7° | 109.5° |
| OAB | CAM | CAW | 111.3° | 109.5° |
| CAM | OAB | HOAB | 109.5° | 114.0° |
| OAB | CAM | HAM | 108.8° | 109.5° |
| OAB | CAM | HAMA | 108.9° | 109.5° |
| OAC | CAQ | CAL | 113.9° | 109.5° |
| OAC | CAQ | CAT | 105.4° | 109.5° |
| CAQ | OAC | HOAC | 109.5° | 113.9° |
| OAC | CAQ | HAQ | 109.5° | 109.5° |
| OAD | CAR | CAN | 114.9° | 109.6° |
| OAD | CAR | CAU | 110.3° | 109.6° |
| CAR | OAD | HOAD | 109.5° | 114.0° |
| OAD | CAR | HAR | 103.6° | 109.6° |
| OAE | CAS | CAO | 110.1° | 109.5° |
| OAE | CAS | CAX | 107.6° | 109.5° |
| CAS | OAE | HOAE | 109.5° | 113.9° |
| OAE | CAS | HAS | 109.7° | 109.4° |
| OAF | CAT | CAQ | 109.2° | 109.5° |
| OAF | CAT | CAV | 110.1° | 109.5° |
| CAT | OAF | HOAF | 109.5° | 114.0° |
| OAF | CAT | HAT | 109.0° | 109.5° |
| OAG | CAU | CAR | 109.3° | 108.9° |
| OAG | CAU | CAW | 108.7° | 108.8° |
| CAU | OAG | HOAG | 109.5° | 114.0° |
| OAG | CAU | HAU | 108.3° | 108.9° |
| OAH | CAV | CAT | 115.5° | 109.4° |
| OAH | CAV | CAX | 109.0° | 109.5° |
| CAV | OAH | HOAH | 109.5° | 114.0° |
| OAH | CAV | HAV | 105.6° | 109.5° |
| OAI | SAZ | OAJ | 108.3° | 112.0° |
| OAI | SAZ | OAK | 107.8° | 112.1° |
| OAI | SAZ | OAP | 111.8° | 106.8° |
| OAJ | SAZ | OAK | 108.8° | 112.0° |
| OAJ | SAZ | OAP | 112.3° | 106.7° |
| OAK | SAZ | OAP | 107.7° | 106.8° |
| CAL | CAQ | CAT | 110.1° | 109.5° |
| CAQ | CAL | HAL | 109.6° | 109.5° |
| CAQ | CAL | HALA | 109.7° | 109.5° |
| CAL | CAQ | HAQ | 104.8° | 109.4° |
| CAM | CAW | CAU | 111.4° | 110.3° |
| CAM | CAW | SAY | 117.5° | 110.3° |
| CAW | CAM | HAM | 108.9° | 109.5° |
| CAW | CAM | HAMA | 108.9° | 109.5° |
| CAM | CAW | HAW | 100.8° | 110.3° |
| CAR | CAN | SAY | 99.9° | 100.9° |
| CAN | CAR | CAU | 104.2° | 109.0° |
| CAR | CAN | HAN | 112.8° | 111.2° |
| CAR | CAN | HANA | 112.8° | 111.1° |
| CAN | CAR | HAR | 109.8° | 109.6° |
| CAN | SAY | CAO | 109.3° | 103.0° |
| CAN | SAY | CAW | 95.4° | 95.9° |
| SAY | CAN | HAN | 112.8° | 111.1° |
| SAY | CAN | HANA | 112.8° | 111.1° |
| CAS | CAO | SAY | 110.9° | 109.5° |
| CAO | CAS | CAX | 107.5° | 109.5° |
| CAS | CAO | HAO | 109.0° | 109.5° |
| CAS | CAO | HAOA | 109.0° | 109.5° |
| CAO | CAS | HAS | 109.7° | 109.5° |
| CAO | SAY | CAW | 100.3° | 103.0° |
| SAY | CAO | HAO | 109.0° | 109.4° |
| SAY | CAO | HAOA | 109.0° | 109.5° |
| CAX | OAP | SAZ | 116.2° | 114.0° |
| OAP | CAX | CAS | 109.4° | 109.5° |
| OAP | CAX | CAV | 113.6° | 109.5° |
| OAP | CAX | HAX | 105.1° | 109.5° |
| CAQ | CAT | CAV | 108.9° | 109.5° |
| CAT | CAQ | HAQ | 113.3° | 109.5° |
| CAQ | CAT | HAT | 110.3° | 109.5° |
| CAR | CAU | CAW | 103.5° | 112.5° |
| CAU | CAR | HAR | 114.4° | 109.5° |
| CAR | CAU | HAU | 113.2° | 108.9° |
| CAS | CAX | CAV | 104.2° | 109.5° |
| CAX | CAS | HAS | 112.2° | 109.4° |
| CAS | CAX | HAX | 114.4° | 109.4° |
| CAT | CAV | CAX | 109.7° | 109.5° |
| CAV | CAT | HAT | 109.4° | 109.4° |
| CAT | CAV | HAV | 104.9° | 109.5° |
| CAU | CAW | SAY | 104.4° | 105.0° |
| CAW | CAU | HAU | 113.7° | 108.8° |
| CAU | CAW | HAW | 114.8° | 110.3° |
| CAX | CAV | HAV | 112.0° | 109.5° |
| CAV | CAX | HAX | 110.3° | 109.5° |
| SAY | CAW | HAW | 108.3° | 110.5° |
| HAL | CAL | HALA | 109.3° | 109.4° |
| HAM | CAM | HAMA | 110.1° | 109.5° |
| HAN | CAN | HANA | 105.9° | 111.0° |
| HAO | CAO | HAOA | 109.9° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAL | CAQ | OAC | 98.0° | 65.0° |
| OAA | CAL | CAQ | HAL | 120.0° | 120.0° |
| OAA | CAL | CAQ | HALA | 120.0° | 120.0° |
| OAA | CAL | CAQ | CAT | 20.2° | 175.0° |
| OAA | CAL | HAL | HALA | 120.2° | 120.0° |
| OAA | CAL | CAQ | HAQ | 142.4° | 55.0° |
| OAB | CAM | CAW | HAM | 120.0° | 120.0° |
| OAB | CAM | CAW | HAMA | 120.0° | 120.0° |
| OAB | CAM | CAW | CAU | 54.7° | 56.5° |
| OAB | CAM | CAW | SAY | 65.7° | 172.0° |
| OAB | CAM | HAM | HAMA | 119.2° | 120.0° |
| OAB | CAM | CAW | HAW | 176.9° | 65.7° |
| OAC | CAQ | CAT | OAF | 35.3° | 65.0° |
| OAC | CAQ | CAL | CAT | 118.2° | 120.0° |
| OAC | CAQ | CAL | HAQ | 119.7° | 120.0° |
| OAC | CAQ | CAT | HAQ | 119.7° | 120.0° |
| OAC | CAQ | CAT | CAV | 84.9° | 55.0° |
| OAC | CAQ | CAL | HAL | 142.0° | 55.0° |
| OAC | CAQ | CAL | HALA | 22.0° | 175.0° |
| OAC | CAQ | CAT | HAT | 155.1° | 175.0° |
| OAD | CAR | CAU | OAG | 59.8° | 149.4° |
| OAD | CAR | CAN | CAU | 120.8° | 120.0° |
| OAD | CAR | CAN | HAR | 116.2° | 120.3° |
| OAD | CAR | CAN | SAY | 171.4° | 78.5° |
| OAD | CAR | CAU | HAR | 116.3° | 120.3° |
| OAD | CAR | CAU | CAW | 175.5° | 89.8° |
| OAD | CAR | CAN | HAN | 51.4° | 39.4° |
| OAD | CAR | CAN | HANA | 68.6° | 163.5° |
| OAD | CAR | CAU | HAU | 61.0° | 30.8° |
| OAE | CAS | CAO | CAX | 116.9° | 120.1° |
| OAE | CAS | CAO | HAS | 120.8° | 119.9° |
| OAE | CAS | CAO | SAY | 64.7° | 65.0° |
| OAE | CAS | CAX | OAP | 167.8° | 173.6° |
| OAE | CAS | CAX | HAS | 120.7° | 120.0° |
| OAE | CAS | CAX | CAV | 45.9° | 66.3° |
| OAE | CAS | CAO | HAO | 175.3° | 175.0° |
| OAE | CAS | CAO | HAOA | 55.3° | 55.1° |
| OAE | CAS | CAX | HAX | 74.6° | 53.6° |
| OAF | CAT | CAV | OAH | 46.4° | 66.1° |
| OAF | CAT | CAQ | CAL | 88.0° | 55.0° |
| OAF | CAT | CAQ | CAV | 120.2° | 120.0° |
| OAF | CAT | CAQ | HAT | 119.8° | 120.0° |
| OAF | CAT | CAV | HAT | 119.8° | 120.0° |
| OAF | CAT | CAV | CAX | 77.2° | 53.9° |
| OAF | CAT | CAQ | HAQ | 155.1° | 174.9° |
| OAF | CAT | CAV | HAV | 162.3° | 173.9° |
| OAG | CAU | CAW | CAM | 76.6° | 123.2° |
| OAG | CAU | CAR | CAN | 176.4° | 90.7° |
| OAG | CAU | CAR | CAW | 115.7° | 120.7° |
| OAG | CAU | CAR | HAU | 120.8° | 118.6° |
| OAG | CAU | CAW | HAU | 120.7° | 118.5° |
| OAG | CAU | CAW | SAY | 155.6° | 118.0° |
| OAG | CAU | CAR | HAR | 56.5° | 29.2° |
| OAG | CAU | CAW | HAW | 37.2° | 1.1° |
| OAH | CAV | CAX | OAP | 54.8° | 54.1° |
| OAH | CAV | CAT | CAQ | 73.2° | 54.0° |
| OAH | CAV | CAX | CAS | 64.2° | 174.1° |
| OAH | CAV | CAT | CAX | 123.6° | 120.0° |
| OAH | CAV | CAT | HAV | 115.9° | 120.0° |
| OAH | CAV | CAX | HAV | 116.5° | 120.0° |
| OAH | CAV | CAT | HAT | 166.2° | 174.0° |
| OAH | CAV | CAX | HAX | 172.5° | 66.0° |
| OAI | SAZ | OAJ | OAK | 116.9° | 126.9° |
| OAI | SAZ | OAJ | OAP | 123.9° | 116.5° |
| OAI | SAZ | OAK | OAP | 120.8° | 116.6° |
| OAI | SAZ | OAP | CAX | 55.5° | 71.6° |
| OAJ | SAZ | OAK | OAP | 122.0° | 116.5° |
| OAJ | SAZ | OAP | CAX | 66.5° | 48.4° |
| OAK | SAZ | OAP | CAX | 173.7° | 168.4° |
| CAL | CAQ | CAT | HAQ | 117.0° | 120.0° |
| CAL | CAQ | CAT | CAV | 151.8° | 175.0° |
| CAQ | CAL | OAA | HOAA | 180.0° | 180.0° |
| CAL | CAQ | OAC | HOAC | 180.0° | 60.1° |
| CAQ | CAL | HAL | HALA | 120.2° | 120.0° |
| CAL | CAQ | CAT | HAT | 31.8° | 65.0° |
| CAM | CAW | SAY | CAN | 132.9° | 138.6° |
| CAM | CAW | SAY | CAO | 116.4° | 116.6° |
| CAM | CAW | CAU | CAR | 167.3° | 116.0° |
| CAM | CAW | CAU | SAY | 127.8° | 118.8° |
| CAM | CAW | CAU | HAW | 113.8° | 122.1° |
| CAM | CAW | SAY | HAW | 113.3° | 122.2° |
| CAW | CAM | OAB | HOAB | 180.0° | 180.0° |
| CAW | CAM | HAM | HAMA | 119.3° | 120.0° |
| CAM | CAW | CAU | HAU | 44.1° | 4.7° |
| CAR | CAN | SAY | HAN | 120.0° | 118.0° |
| CAR | CAN | SAY | HANA | 120.0° | 117.9° |
| CAR | CAN | SAY | CAO | 79.2° | 140.2° |
| CAN | CAR | CAU | HAR | 119.9° | 119.8° |
| CAN | CAR | CAU | CAW | 60.7° | 30.1° |
| CAR | CAN | SAY | CAW | 23.7° | 35.4° |
| CAN | CAR | OAD | HOAD | 180.0° | 61.5° |
| CAR | CAN | HAN | HANA | 123.9° | 124.2° |
| CAN | CAR | CAU | HAU | 62.8° | 150.7° |
| CAN | SAY | CAO | CAS | 96.3° | 73.1° |
| CAN | SAY | CAO | CAW | 99.5° | 99.3° |
| SAY | CAN | CAR | CAU | 50.6° | 41.4° |
| CAN | SAY | CAW | CAU | 9.0° | 19.8° |
| SAY | CAN | HAN | HANA | 123.8° | 124.2° |
| CAN | SAY | CAO | HAO | 143.7° | 166.8° |
| CAN | SAY | CAO | HAOA | 23.7° | 46.9° |
| SAY | CAN | CAR | HAR | 72.4° | 161.2° |
| CAN | SAY | CAW | HAW | 113.8° | 99.2° |
| CAS | CAO | SAY | HAO | 120.0° | 120.0° |
| CAS | CAO | SAY | HAOA | 120.0° | 120.0° |
| CAO | CAS | CAX | OAP | 73.6° | 53.6° |
| CAO | CAS | CAX | HAS | 120.7° | 120.0° |
| CAO | CAS | CAX | CAV | 164.5° | 173.6° |
| CAS | CAO | SAY | CAW | 164.2° | 172.4° |
| CAO | CAS | OAE | HOAE | 180.0° | 60.1° |
| CAS | CAO | HAO | HAOA | 119.4° | 120.0° |
| CAO | CAS | CAX | HAX | 44.0° | 66.4° |
| SAY | CAO | CAS | CAX | 178.3° | 175.0° |
| CAO | SAY | CAW | CAU | 119.7° | 124.6° |
| CAO | SAY | CAN | HAN | 160.8° | 101.8° |
| CAO | SAY | CAN | HANA | 40.8° | 22.2° |
| SAY | CAO | HAO | HAOA | 119.4° | 120.0° |
| SAY | CAO | CAS | HAS | 56.1° | 55.0° |
| CAO | SAY | CAW | HAW | 3.1° | 5.6° |
| OAP | CAX | CAS | CAV | 121.9° | 120.0° |
| OAP | CAX | CAS | HAX | 117.6° | 120.0° |
| OAP | CAX | CAV | CAT | 72.6° | 174.0° |
| OAP | CAX | CAV | HAX | 117.7° | 120.1° |
| OAP | CAX | CAS | HAS | 47.1° | 66.4° |
| OAP | CAX | CAV | HAV | 171.3° | 66.0° |
| SAZ | OAP | CAX | CAS | 122.8° | 130.7° |
| SAZ | OAP | CAX | CAV | 121.2° | 109.3° |
| SAZ | OAP | CAX | HAX | 0.6° | 10.8° |
| CAQ | CAT | CAV | HAT | 120.6° | 120.0° |
| CAQ | CAT | CAV | CAX | 163.1° | 173.9° |
| CAT | CAQ | OAC | HOAC | 59.2° | 60.0° |
| CAQ | CAT | OAF | HOAF | 153.5° | 60.0° |
| CAT | CAQ | CAL | HAL | 99.8° | 65.0° |
| CAT | CAQ | CAL | HALA | 140.2° | 55.0° |
| CAQ | CAT | CAV | HAV | 42.7° | 66.1° |
| CAR | CAU | CAW | HAU | 123.2° | 120.7° |
| CAR | CAU | CAW | SAY | 39.5° | 2.8° |
| CAU | CAR | OAD | HOAD | 62.6° | 179.0° |
| CAR | CAU | OAG | HOAG | 180.0° | 61.4° |
| CAU | CAR | CAN | HAN | 69.4° | 159.4° |
| CAU | CAR | CAN | HANA | 170.6° | 76.5° |
| CAR | CAU | CAW | HAW | 78.9° | 121.8° |
| CAS | CAX | CAV | CAT | 168.4° | 66.0° |
| CAS | CAX | CAV | HAX | 123.3° | 119.9° |
| CAX | CAS | OAE | HOAE | 63.1° | 60.0° |
| CAX | CAS | CAO | HAO | 58.3° | 55.0° |
| CAX | CAS | CAO | HAOA | 61.6° | 65.0° |
| CAS | CAX | CAV | HAV | 52.3° | 54.0° |
| CAT | CAV | CAX | HAV | 116.1° | 120.0° |
| CAV | CAT | OAF | HOAF | 87.1° | 60.0° |
| CAT | CAV | OAH | HOAH | 180.0° | 60.0° |
| CAV | CAT | CAQ | HAQ | 34.9° | 65.0° |
| CAT | CAV | CAX | HAX | 45.1° | 53.9° |
| CAU | CAW | SAY | HAW | 122.8° | 119.0° |
| CAW | CAU | OAG | HOAG | 67.7° | 175.7° |
| CAU | CAW | CAM | HAM | 65.3° | 176.5° |
| CAU | CAW | CAM | HAMA | 174.7° | 63.5° |
| CAW | CAU | CAR | HAR | 59.2° | 149.9° |
| CAX | CAV | OAH | HOAH | 56.1° | 59.9° |
| CAV | CAX | CAS | HAS | 74.8° | 53.6° |
| CAX | CAV | CAT | HAT | 42.6° | 66.1° |
| SAY | CAW | CAM | HAM | 174.4° | 68.0° |
| SAY | CAW | CAM | HAMA | 54.3° | 52.0° |
| CAW | SAY | CAN | HAN | 96.3° | 153.3° |
| CAW | SAY | CAN | HANA | 143.7° | 82.6° |
| CAW | SAY | CAO | HAO | 44.2° | 67.6° |
| CAW | SAY | CAO | HAOA | 75.7° | 52.4° |
| SAY | CAW | CAU | HAU | 83.7° | 123.5° |
| HOAA | OAA | CAL | HAL | 60.0° | 60.0° |
| HOAA | OAA | CAL | HALA | 60.0° | 60.0° |
| HOAB | OAB | CAM | HAM | 60.0° | 60.0° |
| HOAB | OAB | CAM | HAMA | 60.0° | 60.0° |
| HOAC | OAC | CAQ | HAQ | 63.1° | 180.0° |
| HOAD | OAD | CAR | HAR | 60.2° | 58.8° |
| HOAE | OAE | CAS | HAS | 59.1° | 180.0° |
| HOAF | OAF | CAT | HAT | 32.9° | 179.9° |
| HOAG | OAG | CAU | HAU | 56.3° | 57.2° |
| HOAH | OAH | CAV | HAV | 64.5° | 180.0° |
| HAL | CAL | CAQ | HAQ | 22.3° | 175.0° |
| HALA | CAL | CAQ | HAQ | 97.6° | 65.0° |
| HAM | CAM | CAW | HAW | 57.0° | 54.3° |
| HAMA | CAM | CAW | HAW | 63.0° | 174.3° |
| HAN | CAN | CAR | HAR | 167.6° | 80.9° |
| HANA | CAN | CAR | HAR | 47.6° | 43.3° |
| HAO | CAO | CAS | HAS | 63.9° | 65.0° |
| HAOA | CAO | CAS | HAS | 176.1° | 175.0° |
| HAQ | CAQ | CAT | HAT | 85.2° | 55.0° |
| HAR | CAR | CAU | HAU | 177.3° | 89.5° |
| HAS | CAS | CAX | HAX | 164.7° | 173.6° |
| HAT | CAT | CAV | HAV | 77.9° | 53.9° |
| HAU | CAU | CAW | HAW | 157.9° | 117.4° |
| HAV | CAV | CAX | HAX | 71.0° | 174.0° |
