EB7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAN | CAO | sing | 1.53Å | 1.53Å | |
CAN | NAK | sing | 1.46Å | 1.44Å | |
NAK | CAF | sing | 1.39Å | 1.34Å | |
NAK | CAL | sing | 1.36Å | 1.34Å | |
CAA | CAF | doub | 1.38Å | 1.34Å | Aromatic |
CAA | CAB | sing | 1.39Å | 1.40Å | Aromatic |
CAF | CAE | sing | 1.39Å | 1.33Å | Aromatic |
OAM | CAL | doub | 1.22Å | 1.23Å | |
CAB | CAC | doub | 1.39Å | 1.41Å | Aromatic |
CAL | CAJ | sing | 1.47Å | 1.33Å | |
CAE | CAJ | doub | 1.40Å | 1.33Å | Aromatic |
CAE | CAD | sing | 1.40Å | 1.35Å | Aromatic |
CAJ | CAI | sing | 1.39Å | 1.34Å | Aromatic |
CAC | CAD | sing | 1.41Å | 1.42Å | Aromatic |
CAC | NAP | sing | 1.39Å | 1.36Å | |
OAT | SAQ | doub | 1.42Å | 1.52Å | |
CAD | CAG | doub | 1.40Å | 1.40Å | Aromatic |
NAP | SAQ | sing | 1.66Å | 1.80Å | |
CAI | CAH | doub | 1.39Å | 1.40Å | Aromatic |
CAG | CAH | sing | 1.38Å | 1.40Å | Aromatic |
SAQ | OAS | doub | 1.42Å | 1.54Å | |
SAQ | CAR | sing | 1.76Å | 1.79Å | |
CAY | CAR | doub | 1.38Å | 1.39Å | Aromatic |
CAY | CAX | sing | 1.38Å | 1.39Å | Aromatic |
CAR | CAU | sing | 1.38Å | 1.40Å | Aromatic |
CAX | CAW | doub | 1.38Å | 1.39Å | Aromatic |
CAU | CLA | sing | 1.74Å | 1.74Å | |
CAU | CAV | doub | 1.38Å | 1.40Å | Aromatic |
CAW | CAV | sing | 1.38Å | 1.39Å | Aromatic |
CAW | FBA | sing | 1.35Å | 1.31Å | |
CAV | H1 | sing | 1.08Å | 1.08Å | |
CAX | H2 | sing | 1.08Å | 1.08Å | |
CAY | H3 | sing | 1.08Å | 1.08Å | |
NAP | H4 | sing | 0.97Å | 1.00Å | |
CAB | H5 | sing | 1.08Å | 1.08Å | |
CAA | H6 | sing | 1.08Å | 1.08Å | |
CAG | H7 | sing | 1.08Å | 1.08Å | |
CAH | H8 | sing | 1.08Å | 1.08Å | |
CAI | H9 | sing | 1.08Å | 1.08Å | |
CAN | H10 | sing | 1.09Å | 1.10Å | |
CAN | H11 | sing | 1.09Å | 1.10Å | |
CAO | H12 | sing | 1.09Å | 1.10Å | |
CAO | H13 | sing | 1.09Å | 1.10Å | |
CAO | H14 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAO | CAN | NAK | 109.3° | 109.5° |
CAO | CAN | H10 | 109.5° | 109.5° |
CAO | CAN | H11 | 109.5° | 109.4° |
CAN | CAO | H12 | 109.5° | 109.4° |
CAN | CAO | H13 | 109.5° | 109.4° |
CAN | CAO | H14 | 109.5° | 109.5° |
CAN | NAK | CAF | 125.4° | 124.9° |
CAN | NAK | CAL | 127.5° | 124.9° |
NAK | CAN | H10 | 109.5° | 109.5° |
NAK | CAN | H11 | 109.5° | 109.5° |
CAF | NAK | CAL | 107.1° | 110.3° |
NAK | CAF | CAA | 133.6° | 136.7° |
NAK | CAF | CAE | 107.3° | 106.8° |
NAK | CAL | OAM | 125.5° | 126.0° |
NAK | CAL | CAJ | 110.0° | 108.0° |
CAF | CAA | CAB | 120.1° | 120.2° |
CAA | CAF | CAE | 119.1° | 116.4° |
CAF | CAA | H6 | 119.9° | 119.9° |
CAA | CAB | CAC | 120.5° | 122.9° |
CAA | CAB | H5 | 119.7° | 118.6° |
CAB | CAA | H6 | 119.9° | 119.9° |
CAF | CAE | CAJ | 109.9° | 110.6° |
CAF | CAE | CAD | 125.1° | 125.2° |
OAM | CAL | CAJ | 124.4° | 126.0° |
CAB | CAC | CAD | 117.0° | 118.2° |
CAB | CAC | NAP | 125.0° | 120.8° |
CAC | CAB | H5 | 119.7° | 118.5° |
CAL | CAJ | CAE | 105.7° | 104.3° |
CAL | CAJ | CAI | 134.3° | 138.9° |
CAJ | CAE | CAD | 124.9° | 124.2° |
CAE | CAJ | CAI | 120.0° | 116.9° |
CAE | CAD | CAC | 118.1° | 117.0° |
CAE | CAD | CAG | 116.7° | 117.3° |
CAJ | CAI | CAH | 119.7° | 119.7° |
CAJ | CAI | H9 | 120.2° | 120.1° |
CAD | CAC | NAP | 117.9° | 120.9° |
CAC | CAD | CAG | 125.2° | 125.6° |
CAC | NAP | SAQ | 126.1° | 120.0° |
CAC | NAP | H4 | 105.2° | 120.0° |
OAT | SAQ | NAP | 88.4° | 106.4° |
OAT | SAQ | OAS | 119.9° | 123.2° |
OAT | SAQ | CAR | 119.2° | 106.4° |
CAD | CAG | CAH | 119.3° | 118.9° |
CAD | CAG | H7 | 120.4° | 120.5° |
NAP | SAQ | OAS | 83.3° | 106.4° |
NAP | SAQ | CAR | 90.8° | 107.2° |
SAQ | NAP | H4 | 105.1° | 120.0° |
CAI | CAH | CAG | 119.4° | 123.0° |
CAI | CAH | H8 | 120.3° | 118.5° |
CAH | CAI | H9 | 120.1° | 120.2° |
CAH | CAG | H7 | 120.3° | 120.6° |
CAG | CAH | H8 | 120.3° | 118.5° |
OAS | SAQ | CAR | 120.4° | 106.4° |
SAQ | CAR | CAY | 115.4° | 120.0° |
SAQ | CAR | CAU | 124.7° | 119.9° |
CAR | CAY | CAX | 120.6° | 120.0° |
CAY | CAR | CAU | 119.8° | 120.1° |
CAR | CAY | H3 | 119.7° | 120.0° |
CAY | CAX | CAW | 119.9° | 120.0° |
CAY | CAX | H2 | 120.0° | 120.0° |
CAX | CAY | H3 | 119.7° | 120.0° |
CAR | CAU | CLA | 122.7° | 120.1° |
CAR | CAU | CAV | 119.4° | 120.0° |
CAX | CAW | CAV | 120.0° | 120.0° |
CAX | CAW | FBA | 119.7° | 120.0° |
CAW | CAX | H2 | 120.1° | 120.0° |
CLA | CAU | CAV | 117.9° | 120.0° |
CAU | CAV | CAW | 120.3° | 120.0° |
CAU | CAV | H1 | 119.9° | 120.0° |
CAV | CAW | FBA | 120.3° | 120.0° |
CAW | CAV | H1 | 119.9° | 120.0° |
H10 | CAN | H11 | 109.5° | 109.4° |
H12 | CAO | H13 | 109.5° | 109.5° |
H12 | CAO | H14 | 109.4° | 109.5° |
H13 | CAO | H14 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAO | CAN | NAK | H10 | 120.0° | 120.1° |
CAO | CAN | NAK | H11 | 120.0° | 120.0° |
CAO | CAN | NAK | CAF | 119.2° | 90.0° |
CAO | CAN | NAK | CAL | 64.8° | 90.0° |
CAO | CAN | H10 | H11 | 120.1° | 120.0° |
CAN | CAO | H12 | H13 | 120.0° | 119.9° |
CAN | CAO | H12 | H14 | 120.0° | 120.0° |
CAN | CAO | H13 | H14 | 120.0° | 120.0° |
CAN | NAK | CAF | CAL | 176.7° | 180.0° |
CAN | NAK | CAF | CAA | 2.9° | 0.1° |
CAN | NAK | CAF | CAE | 177.2° | 180.0° |
CAN | NAK | CAL | OAM | 2.4° | 0.1° |
CAN | NAK | CAL | CAJ | 177.4° | 180.0° |
NAK | CAN | H10 | H11 | 120.1° | 120.0° |
NAK | CAN | CAO | H12 | 180.0° | 60.0° |
NAK | CAN | CAO | H13 | 60.0° | 60.0° |
NAK | CAN | CAO | H14 | 60.0° | 180.0° |
NAK | CAF | CAA | CAE | 180.0° | 180.0° |
NAK | CAF | CAA | CAB | 179.9° | 180.0° |
CAF | NAK | CAL | OAM | 179.0° | 179.9° |
CAF | NAK | CAL | CAJ | 0.8° | 0.0° |
NAK | CAF | CAE | CAJ | 0.0° | 0.0° |
NAK | CAF | CAE | CAD | 179.7° | 180.0° |
NAK | CAF | CAA | H6 | 0.1° | 0.0° |
CAF | NAK | CAN | H10 | 120.8° | 150.0° |
CAF | NAK | CAN | H11 | 0.8° | 30.0° |
CAL | NAK | CAF | CAA | 179.6° | 179.9° |
CAL | NAK | CAF | CAE | 0.5° | 0.0° |
NAK | CAL | OAM | CAJ | 179.7° | 179.9° |
NAK | CAL | CAJ | CAE | 0.8° | 0.0° |
NAK | CAL | CAJ | CAI | 179.7° | 179.9° |
CAL | NAK | CAN | H10 | 55.2° | 30.0° |
CAL | NAK | CAN | H11 | 175.2° | 150.0° |
CAF | CAA | CAB | H6 | 180.0° | 180.0° |
CAF | CAA | CAB | CAC | 1.3° | 0.1° |
CAA | CAF | CAE | CAJ | 180.0° | 180.0° |
CAA | CAF | CAE | CAD | 0.3° | 0.0° |
CAF | CAA | CAB | H5 | 178.7° | 180.0° |
CAB | CAA | CAF | CAE | 0.1° | 0.0° |
CAA | CAB | CAC | H5 | 180.0° | 179.9° |
CAA | CAB | CAC | CAD | 2.3° | 0.1° |
CAA | CAB | CAC | NAP | 178.2° | 179.7° |
CAF | CAE | CAJ | CAL | 0.5° | 0.0° |
CAF | CAE | CAJ | CAD | 179.7° | 180.0° |
CAF | CAE | CAJ | CAI | 180.0° | 180.0° |
CAF | CAE | CAD | CAC | 0.8° | 0.0° |
CAF | CAE | CAD | CAG | 179.7° | 179.7° |
CAE | CAF | CAA | H6 | 180.0° | 180.0° |
OAM | CAL | CAJ | CAE | 179.0° | 179.9° |
OAM | CAL | CAJ | CAI | 0.5° | 0.0° |
CAB | CAC | CAD | CAE | 2.0° | 0.1° |
CAB | CAC | CAD | NAP | 176.3° | 179.6° |
CAB | CAC | CAD | CAG | 179.2° | 179.6° |
CAB | CAC | NAP | SAQ | 53.9° | 35.5° |
CAB | CAC | NAP | H4 | 176.1° | 144.6° |
CAC | CAB | CAA | H6 | 178.7° | 180.0° |
CAL | CAJ | CAE | CAI | 179.6° | 180.0° |
CAL | CAJ | CAE | CAD | 179.9° | 180.0° |
CAL | CAJ | CAI | CAH | 179.8° | 179.7° |
CAL | CAJ | CAI | H9 | 0.2° | 0.0° |
CAJ | CAE | CAD | CAC | 178.8° | 180.0° |
CAJ | CAE | CAD | CAG | 0.1° | 0.3° |
CAE | CAJ | CAI | CAH | 0.4° | 0.4° |
CAE | CAJ | CAI | H9 | 179.6° | 180.0° |
CAD | CAE | CAJ | CAI | 0.3° | 0.1° |
CAE | CAD | CAC | CAG | 178.8° | 179.7° |
CAE | CAD | CAC | NAP | 178.2° | 179.7° |
CAE | CAD | CAG | CAH | 0.0° | 0.3° |
CAE | CAD | CAG | H7 | 180.0° | 179.7° |
CAJ | CAI | CAH | H9 | 180.0° | 179.6° |
CAJ | CAI | CAH | CAG | 0.3° | 0.3° |
CAJ | CAI | CAH | H8 | 179.7° | 179.7° |
CAD | CAC | NAP | SAQ | 130.2° | 144.9° |
CAC | CAD | CAG | CAH | 178.9° | 180.0° |
CAD | CAC | NAP | H4 | 7.9° | 35.0° |
CAD | CAC | CAB | H5 | 177.8° | 180.0° |
CAC | CAD | CAG | H7 | 1.2° | 0.0° |
CAC | NAP | SAQ | OAT | 52.8° | 45.6° |
NAP | CAC | CAD | CAG | 2.9° | 0.0° |
CAC | NAP | SAQ | H4 | 122.2° | 179.9° |
CAC | NAP | SAQ | OAS | 173.1° | 178.6° |
CAC | NAP | SAQ | CAR | 66.4° | 67.9° |
NAP | CAC | CAB | H5 | 1.8° | 0.4° |
OAT | SAQ | NAP | OAS | 120.3° | 132.9° |
OAT | SAQ | NAP | CAR | 119.2° | 113.5° |
OAT | SAQ | OAS | CAR | 171.4° | 123.0° |
OAT | SAQ | CAR | CAY | 21.2° | 3.2° |
OAT | SAQ | CAR | CAU | 162.6° | 177.4° |
OAT | SAQ | NAP | H4 | 175.0° | 134.3° |
CAD | CAG | CAH | CAI | 0.1° | 0.0° |
CAD | CAG | CAH | H7 | 180.0° | 180.0° |
CAD | CAG | CAH | H8 | 179.9° | 180.0° |
NAP | SAQ | OAS | CAR | 87.0° | 114.1° |
NAP | SAQ | CAR | CAY | 109.9° | 116.7° |
NAP | SAQ | CAR | CAU | 73.9° | 63.9° |
CAI | CAH | CAG | H8 | 180.0° | 180.0° |
CAI | CAH | CAG | H7 | 179.9° | 180.0° |
CAG | CAH | CAI | H9 | 179.7° | 180.0° |
OAS | SAQ | CAR | CAY | 167.4° | 129.8° |
OAS | SAQ | CAR | CAU | 8.8° | 49.7° |
OAS | SAQ | NAP | H4 | 64.7° | 1.3° |
SAQ | CAR | CAY | CAU | 176.4° | 179.5° |
SAQ | CAR | CAY | CAX | 178.4° | 179.9° |
SAQ | CAR | CAU | CLA | 3.0° | 0.3° |
SAQ | CAR | CAU | CAV | 178.1° | 179.9° |
SAQ | CAR | CAY | H3 | 1.6° | 0.5° |
CAR | SAQ | NAP | H4 | 55.8° | 112.2° |
CAR | CAY | CAX | H3 | 180.0° | 179.5° |
CAR | CAY | CAX | CAW | 0.9° | 0.2° |
CAY | CAR | CAU | CLA | 179.1° | 179.8° |
CAY | CAR | CAU | CAV | 2.1° | 0.5° |
CAR | CAY | CAX | H2 | 179.1° | 179.7° |
CAX | CAY | CAR | CAU | 2.0° | 0.5° |
CAY | CAX | CAW | H2 | 180.0° | 179.9° |
CAY | CAX | CAW | CAV | 0.1° | 0.1° |
CAY | CAX | CAW | FBA | 179.8° | 179.9° |
CAR | CAU | CLA | CAV | 178.9° | 179.8° |
CAR | CAU | CAV | CAW | 1.1° | 0.2° |
CAR | CAU | CAV | H1 | 178.9° | 179.7° |
CAU | CAR | CAY | H3 | 178.0° | 180.0° |
CAX | CAW | CAV | CAU | 0.0° | 0.1° |
CAX | CAW | CAV | FBA | 179.9° | 180.0° |
CAX | CAW | CAV | H1 | 180.0° | 180.0° |
CAW | CAX | CAY | H3 | 179.1° | 179.7° |
CLA | CAU | CAV | CAW | 180.0° | 179.9° |
CLA | CAU | CAV | H1 | 0.0° | 0.0° |
CAU | CAV | CAW | H1 | 180.0° | 179.9° |
CAU | CAV | CAW | FBA | 179.9° | 179.9° |
CAV | CAW | CAX | H2 | 179.9° | 180.0° |
FBA | CAW | CAV | H1 | 0.1° | 0.0° |
FBA | CAW | CAX | H2 | 0.2° | 0.0° |
H2 | CAX | CAY | H3 | 0.9° | 0.2° |
H5 | CAB | CAA | H6 | 1.3° | 0.1° |
H7 | CAG | CAH | H8 | 0.1° | 0.0° |
H8 | CAH | CAI | H9 | 0.3° | 0.0° |
H10 | CAN | CAO | H12 | 60.0° | 180.0° |
H10 | CAN | CAO | H13 | 60.0° | 60.1° |
H10 | CAN | CAO | H14 | 180.0° | 60.0° |
H11 | CAN | CAO | H12 | 60.0° | 60.0° |
H11 | CAN | CAO | H13 | 180.0° | 180.0° |
H11 | CAN | CAO | H14 | 60.0° | 60.0° |
H12 | CAO | H13 | H14 | 120.0° | 120.1° |