N8G
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
NAA | CAT | sing | 1.38Å | 1.34Å | |
CAT | NAN | doub | 1.33Å | 1.34Å | |
CAT | CAU | sing | 1.41Å | 1.42Å | |
NAN | CAV | sing | 1.33Å | 1.36Å | |
FAJ | CAU | sing | 1.35Å | 1.35Å | |
CAU | CAK | doub | 1.35Å | 1.33Å | |
CAV | OAB | doub | 1.22Å | 1.23Å | |
CAV | NAY | sing | 1.35Å | 1.40Å | |
CAK | NAY | sing | 1.36Å | 1.37Å | |
NAY | CAX | sing | 1.46Å | 1.47Å | |
OAH | PBA | doub | 1.48Å | 1.48Å | |
OAG | PAZ | doub | 1.48Å | 1.53Å | |
CAX | CAM | sing | 1.54Å | 1.52Å | |
CAX | OAP | sing | 1.42Å | 1.42Å | |
OAR | PBA | sing | 1.61Å | 1.59Å | |
OAR | PBB | sing | 1.61Å | 1.59Å | |
CAM | SAS | sing | 1.84Å | 1.81Å | |
PBA | OAO | sing | 1.61Å | 1.59Å | |
PBA | OAD | sing | 1.61Å | 1.54Å | |
OAE | PBB | doub | 1.48Å | 1.47Å | |
OAO | CAL | sing | 1.43Å | 1.44Å | |
SAS | CAW | sing | 1.84Å | 1.81Å | |
OAP | CAW | sing | 1.45Å | 1.44Å | |
PBB | OAQ | sing | 1.61Å | 1.59Å | |
PBB | OAI | sing | 1.61Å | 1.52Å | |
PAZ | OAC | sing | 1.61Å | 1.53Å | |
PAZ | OAQ | sing | 1.61Å | 1.59Å | |
PAZ | OAF | sing | 1.61Å | 1.50Å | |
CAW | CAL | sing | 1.53Å | 1.51Å | |
OAC | H1 | sing | 0.97Å | 0.95Å | |
OAF | H2 | sing | 0.97Å | 0.95Å | |
OAI | H3 | sing | 0.97Å | 0.95Å | |
OAD | H4 | sing | 0.97Å | 0.95Å | |
CAL | H5 | sing | 1.09Å | 1.10Å | |
CAL | H6 | sing | 1.09Å | 1.10Å | |
CAW | H7 | sing | 1.09Å | 1.10Å | |
CAM | H8 | sing | 1.09Å | 1.10Å | |
CAM | H9 | sing | 1.09Å | 1.10Å | |
CAX | H10 | sing | 1.09Å | 1.10Å | |
CAK | H11 | sing | 1.08Å | 1.08Å | |
NAA | H12 | sing | 0.97Å | 1.00Å | |
NAA | H13 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
NAA | CAT | NAN | 119.5° | 120.2° |
NAA | CAT | CAU | 120.7° | 120.2° |
CAT | NAA | H12 | 120.0° | 120.0° |
CAT | NAA | H13 | 120.0° | 120.0° |
NAN | CAT | CAU | 119.7° | 119.7° |
CAT | NAN | CAV | 121.1° | 120.7° |
CAT | CAU | FAJ | 118.3° | 120.6° |
CAT | CAU | CAK | 120.0° | 118.9° |
NAN | CAV | OAB | 122.3° | 119.5° |
NAN | CAV | NAY | 118.6° | 121.1° |
FAJ | CAU | CAK | 121.6° | 120.5° |
CAU | CAK | NAY | 119.8° | 119.3° |
CAU | CAK | H11 | 120.1° | 120.3° |
OAB | CAV | NAY | 119.0° | 119.4° |
CAV | NAY | CAK | 120.7° | 120.3° |
CAV | NAY | CAX | 118.4° | 119.9° |
CAK | NAY | CAX | 120.9° | 119.9° |
NAY | CAK | H11 | 120.1° | 120.4° |
NAY | CAX | CAM | 112.4° | 108.8° |
NAY | CAX | OAP | 107.9° | 108.8° |
NAY | CAX | H10 | 108.9° | 108.6° |
OAH | PBA | OAR | 111.1° | 109.5° |
OAH | PBA | OAO | 112.5° | 109.5° |
OAH | PBA | OAD | 114.1° | 109.5° |
OAG | PAZ | OAC | 108.8° | 109.5° |
OAG | PAZ | OAQ | 105.7° | 109.5° |
OAG | PAZ | OAF | 113.3° | 109.5° |
CAM | CAX | OAP | 109.9° | 113.0° |
CAX | CAM | SAS | 104.7° | 102.6° |
CAX | CAM | H8 | 110.6° | 110.8° |
CAX | CAM | H9 | 110.7° | 110.9° |
CAM | CAX | H10 | 108.2° | 108.8° |
CAX | OAP | CAW | 113.0° | 112.4° |
OAP | CAX | H10 | 109.6° | 108.8° |
PBA | OAR | PBB | 133.5° | 134.0° |
OAR | PBA | OAO | 105.1° | 109.5° |
OAR | PBA | OAD | 106.7° | 109.5° |
OAR | PBB | OAE | 111.6° | 109.5° |
OAR | PBB | OAQ | 102.3° | 109.5° |
OAR | PBB | OAI | 106.9° | 109.5° |
CAM | SAS | CAW | 87.5° | 94.2° |
SAS | CAM | H8 | 110.6° | 110.8° |
SAS | CAM | H9 | 110.6° | 110.8° |
OAO | PBA | OAD | 106.8° | 109.5° |
PBA | OAO | CAL | 129.7° | 123.0° |
PBA | OAD | H4 | 109.5° | 114.0° |
OAE | PBB | OAQ | 112.5° | 109.4° |
OAE | PBB | OAI | 116.1° | 109.4° |
OAO | CAL | CAW | 103.4° | 109.5° |
OAO | CAL | H5 | 111.0° | 109.5° |
OAO | CAL | H6 | 111.0° | 109.4° |
SAS | CAW | OAP | 106.3° | 100.9° |
SAS | CAW | CAL | 113.8° | 111.2° |
SAS | CAW | H7 | 106.3° | 111.1° |
OAP | CAW | CAL | 109.9° | 111.2° |
OAP | CAW | H7 | 110.7° | 111.1° |
OAQ | PBB | OAI | 106.4° | 109.5° |
PBB | OAQ | PAZ | 136.3° | 134.0° |
PBB | OAI | H3 | 109.5° | 113.9° |
OAC | PAZ | OAQ | 104.5° | 109.5° |
OAC | PAZ | OAF | 113.0° | 109.5° |
PAZ | OAC | H1 | 109.5° | 113.9° |
OAQ | PAZ | OAF | 110.8° | 109.5° |
PAZ | OAF | H2 | 109.5° | 114.0° |
CAW | CAL | H5 | 111.0° | 109.5° |
CAW | CAL | H6 | 111.0° | 109.5° |
CAL | CAW | H7 | 109.8° | 111.0° |
H5 | CAL | H6 | 109.5° | 109.5° |
H8 | CAM | H9 | 109.5° | 110.7° |
H12 | NAA | H13 | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
NAA | CAT | NAN | CAU | 179.3° | 179.7° |
NAA | CAT | NAN | CAV | 179.0° | 180.0° |
NAA | CAT | CAU | FAJ | 0.5° | 0.0° |
NAA | CAT | CAU | CAK | 179.5° | 180.0° |
CAT | NAA | H12 | H13 | 180.0° | 180.0° |
NAN | CAT | CAU | FAJ | 179.7° | 179.7° |
NAN | CAT | CAU | CAK | 0.2° | 0.3° |
CAT | NAN | CAV | OAB | 177.1° | 179.9° |
CAT | NAN | CAV | NAY | 0.9° | 0.0° |
NAN | CAT | NAA | H12 | 0.0° | 0.0° |
NAN | CAT | NAA | H13 | 180.0° | 180.0° |
CAU | CAT | NAN | CAV | 0.3° | 0.3° |
CAT | CAU | FAJ | CAK | 180.0° | 180.0° |
CAT | CAU | CAK | NAY | 0.1° | 0.0° |
CAT | CAU | CAK | H11 | 179.9° | 180.0° |
CAU | CAT | NAA | H12 | 179.3° | 179.7° |
CAU | CAT | NAA | H13 | 0.7° | 0.3° |
NAN | CAV | OAB | NAY | 177.9° | 180.0° |
NAN | CAV | NAY | CAK | 1.0° | 0.3° |
NAN | CAV | NAY | CAX | 178.2° | 180.0° |
FAJ | CAU | CAK | NAY | 179.8° | 180.0° |
FAJ | CAU | CAK | H11 | 0.2° | 0.0° |
CAU | CAK | NAY | CAV | 0.5° | 0.3° |
CAU | CAK | NAY | H11 | 180.0° | 180.0° |
CAU | CAK | NAY | CAX | 178.7° | 179.9° |
OAB | CAV | NAY | CAK | 177.0° | 179.8° |
OAB | CAV | NAY | CAX | 3.8° | 0.1° |
CAV | NAY | CAK | CAX | 179.2° | 179.7° |
CAV | NAY | CAX | CAM | 77.7° | 65.3° |
CAV | NAY | CAX | OAP | 161.1° | 58.2° |
CAV | NAY | CAX | H10 | 42.2° | 176.5° |
CAV | NAY | CAK | H11 | 179.5° | 179.7° |
CAK | NAY | CAX | CAM | 101.5° | 115.0° |
CAK | NAY | CAX | OAP | 19.7° | 121.5° |
CAK | NAY | CAX | H10 | 138.6° | 3.2° |
NAY | CAX | CAM | OAP | 120.1° | 121.0° |
NAY | CAX | CAM | H10 | 120.3° | 118.1° |
NAY | CAX | OAP | H10 | 118.4° | 118.2° |
NAY | CAX | CAM | SAS | 91.2° | 125.4° |
NAY | CAX | OAP | CAW | 121.9° | 153.9° |
NAY | CAX | CAM | H8 | 149.6° | 7.1° |
NAY | CAX | CAM | H9 | 28.0° | 116.2° |
CAX | NAY | CAK | H11 | 1.3° | 0.1° |
OAH | PBA | OAR | OAO | 121.9° | 120.0° |
OAH | PBA | OAR | OAD | 125.0° | 120.0° |
OAH | PBA | OAR | PBB | 151.4° | 45.0° |
OAH | PBA | OAO | OAD | 125.9° | 120.0° |
OAH | PBA | OAO | CAL | 143.8° | 55.0° |
OAH | PBA | OAD | H4 | 0.0° | 180.0° |
OAG | PAZ | OAQ | PBB | 21.5° | 45.0° |
OAG | PAZ | OAC | OAQ | 112.6° | 120.0° |
OAG | PAZ | OAC | OAF | 126.8° | 120.0° |
OAG | PAZ | OAQ | OAF | 123.2° | 120.0° |
OAG | PAZ | OAC | H1 | 0.0° | 180.0° |
OAG | PAZ | OAF | H2 | 0.0° | 60.0° |
CAM | CAX | OAP | H10 | 118.8° | 120.9° |
CAX | CAM | SAS | H8 | 119.2° | 118.3° |
CAX | CAM | SAS | H9 | 119.2° | 118.4° |
CAX | CAM | SAS | CAW | 37.6° | 17.4° |
CAM | CAX | OAP | CAW | 0.9° | 33.0° |
CAX | CAM | H8 | H9 | 122.2° | 123.5° |
OAP | CAX | CAM | SAS | 28.9° | 4.5° |
CAX | OAP | CAW | SAS | 27.7° | 43.1° |
CAX | OAP | CAW | CAL | 151.3° | 161.1° |
CAX | OAP | CAW | H7 | 87.3° | 74.8° |
OAP | CAX | CAM | H8 | 90.3° | 113.8° |
OAP | CAX | CAM | H9 | 148.1° | 122.8° |
OAR | PBA | OAO | OAD | 113.0° | 120.0° |
PBA | OAR | PBB | OAE | 174.0° | 45.0° |
OAR | PBA | OAO | CAL | 95.2° | 175.0° |
PBA | OAR | PBB | OAQ | 65.5° | 165.0° |
PBA | OAR | PBB | OAI | 46.1° | 75.0° |
OAR | PBA | OAD | H4 | 123.1° | 60.1° |
PBB | OAR | PBA | OAO | 86.7° | 165.0° |
PBB | OAR | PBA | OAD | 26.4° | 75.0° |
OAR | PBB | OAE | OAQ | 114.4° | 120.0° |
OAR | PBB | OAE | OAI | 122.8° | 120.0° |
OAR | PBB | OAQ | OAI | 112.0° | 120.0° |
OAR | PBB | OAQ | PAZ | 73.6° | 160.0° |
OAR | PBB | OAI | H3 | 125.2° | 60.1° |
CAM | SAS | CAW | OAP | 37.9° | 34.1° |
CAM | SAS | CAW | CAL | 159.0° | 152.0° |
CAM | SAS | CAW | H7 | 80.1° | 83.8° |
SAS | CAM | H8 | H9 | 122.2° | 123.3° |
SAS | CAM | CAX | H10 | 148.6° | 116.4° |
PBA | OAO | CAL | CAW | 139.7° | 180.0° |
OAO | PBA | OAD | H4 | 124.9° | 60.0° |
PBA | OAO | CAL | H5 | 20.7° | 60.0° |
PBA | OAO | CAL | H6 | 101.3° | 60.1° |
OAD | PBA | OAO | CAL | 17.9° | 65.0° |
OAE | PBB | OAQ | OAI | 128.2° | 119.9° |
OAE | PBB | OAQ | PAZ | 46.3° | 40.0° |
OAE | PBB | OAI | H3 | 0.0° | 179.9° |
OAO | CAL | CAW | SAS | 38.9° | 55.1° |
OAO | CAL | CAW | OAP | 80.1° | 56.4° |
OAO | CAL | CAW | H5 | 119.0° | 120.0° |
OAO | CAL | CAW | H6 | 119.0° | 119.9° |
OAO | CAL | H5 | H6 | 122.8° | 120.0° |
OAO | CAL | CAW | H7 | 157.9° | 179.4° |
SAS | CAW | OAP | CAL | 123.5° | 118.0° |
SAS | CAW | OAP | H7 | 115.1° | 117.9° |
SAS | CAW | CAL | H7 | 119.0° | 124.3° |
SAS | CAW | CAL | H5 | 80.1° | 64.9° |
SAS | CAW | CAL | H6 | 157.9° | 175.0° |
CAW | SAS | CAM | H8 | 81.7° | 135.7° |
CAW | SAS | CAM | H9 | 156.8° | 101.0° |
OAP | CAW | CAL | H7 | 121.9° | 124.2° |
OAP | CAW | CAL | H5 | 160.9° | 176.5° |
OAP | CAW | CAL | H6 | 38.9° | 63.5° |
CAW | OAP | CAX | H10 | 119.7° | 87.9° |
PBB | OAQ | PAZ | OAC | 136.4° | 75.0° |
PBB | OAQ | PAZ | OAF | 101.6° | 165.0° |
OAQ | PBB | OAI | H3 | 126.1° | 60.0° |
OAI | PBB | OAQ | PAZ | 174.4° | 79.9° |
OAC | PAZ | OAQ | OAF | 122.0° | 120.0° |
OAC | PAZ | OAF | H2 | 124.4° | 60.0° |
OAQ | PAZ | OAC | H1 | 112.6° | 60.0° |
OAQ | PAZ | OAF | H2 | 118.6° | 180.0° |
OAF | PAZ | OAC | H1 | 126.8° | 60.0° |
CAW | CAL | H5 | H6 | 122.8° | 120.0° |
H5 | CAL | CAW | H7 | 38.9° | 59.3° |
H6 | CAL | CAW | H7 | 83.0° | 60.7° |
H8 | CAM | CAX | H10 | 29.3° | 125.2° |
H9 | CAM | CAX | H10 | 92.2° | 1.9° |