L6Y
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAV | CAU | doub | 1.38Å | 1.39Å | Aromatic |
CAV | CAW | sing | 1.38Å | 1.38Å | Aromatic |
CAU | CAT | sing | 1.38Å | 1.40Å | Aromatic |
CAW | CAR | doub | 1.40Å | 1.39Å | Aromatic |
CAT | CAS | doub | 1.38Å | 1.40Å | Aromatic |
CAR | CAS | sing | 1.40Å | 1.39Å | Aromatic |
CAR | CAP | sing | 1.48Å | 1.40Å | |
OAQ | CAP | doub | 1.21Å | 1.23Å | |
CAP | CAA | sing | 1.48Å | 1.40Å | |
CAA | CAB | sing | 1.39Å | 1.40Å | Aromatic |
CAA | CAF | doub | 1.42Å | 1.39Å | Aromatic |
CAB | CAC | doub | 1.39Å | 1.40Å | Aromatic |
CAG | CAF | sing | 1.40Å | 1.39Å | Aromatic |
CAG | CAH | doub | 1.37Å | 1.39Å | Aromatic |
CAF | CAE | sing | 1.41Å | 1.39Å | Aromatic |
CAH | CAI | sing | 1.39Å | 1.39Å | Aromatic |
CAC | CAD | sing | 1.39Å | 1.39Å | Aromatic |
CAE | CAD | doub | 1.41Å | 1.39Å | Aromatic |
CAE | CAJ | sing | 1.41Å | 1.38Å | Aromatic |
CAD | CAN | sing | 1.47Å | 1.40Å | |
CAI | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
CAJ | CAK | sing | 1.47Å | 1.39Å | |
CAN | OAO | doub | 1.22Å | 1.24Å | |
CAN | NAM | sing | 1.35Å | 1.35Å | |
CAK | NAM | sing | 1.35Å | 1.36Å | |
CAK | OAL | doub | 1.22Å | 1.23Å | |
NAM | OAX | sing | 1.42Å | 1.42Å | |
OAX | H1 | sing | 0.97Å | 0.95Å | |
CAI | H2 | sing | 1.08Å | 1.08Å | |
CAH | H3 | sing | 1.08Å | 1.08Å | |
CAG | H4 | sing | 1.08Å | 1.08Å | |
CAC | H5 | sing | 1.08Å | 1.08Å | |
CAB | H6 | sing | 1.08Å | 1.08Å | |
CAS | H7 | sing | 1.08Å | 1.08Å | |
CAT | H8 | sing | 1.08Å | 1.08Å | |
CAU | H9 | sing | 1.08Å | 1.08Å | |
CAV | H10 | sing | 1.08Å | 1.08Å | |
CAW | H11 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAU | CAV | CAW | 119.5° | 120.2° |
CAV | CAU | CAT | 119.7° | 120.3° |
CAV | CAU | H9 | 120.2° | 119.9° |
CAU | CAV | H10 | 120.2° | 119.9° |
CAV | CAW | CAR | 120.7° | 119.8° |
CAW | CAV | H10 | 120.2° | 120.0° |
CAV | CAW | H11 | 119.7° | 120.1° |
CAU | CAT | CAS | 120.8° | 120.2° |
CAU | CAT | H8 | 119.6° | 119.9° |
CAT | CAU | H9 | 120.1° | 119.8° |
CAW | CAR | CAS | 120.6° | 119.7° |
CAW | CAR | CAP | 117.5° | 120.1° |
CAR | CAW | H11 | 119.7° | 120.1° |
CAT | CAS | CAR | 118.7° | 119.8° |
CAT | CAS | H7 | 120.6° | 120.1° |
CAS | CAT | H8 | 119.6° | 119.9° |
CAS | CAR | CAP | 121.9° | 120.1° |
CAR | CAS | H7 | 120.7° | 120.1° |
CAR | CAP | OAQ | 119.7° | 120.0° |
CAR | CAP | CAA | 120.0° | 120.0° |
OAQ | CAP | CAA | 120.2° | 120.0° |
CAP | CAA | CAB | 122.5° | 120.2° |
CAP | CAA | CAF | 118.1° | 120.2° |
CAB | CAA | CAF | 119.3° | 119.6° |
CAA | CAB | CAC | 120.3° | 121.2° |
CAA | CAB | H6 | 119.9° | 119.4° |
CAA | CAF | CAG | 120.0° | 122.1° |
CAA | CAF | CAE | 120.2° | 118.9° |
CAB | CAC | CAD | 120.1° | 120.4° |
CAB | CAC | H5 | 120.0° | 119.8° |
CAC | CAB | H6 | 119.8° | 119.4° |
CAF | CAG | CAH | 119.9° | 120.1° |
CAG | CAF | CAE | 119.8° | 119.1° |
CAF | CAG | H4 | 120.1° | 120.0° |
CAG | CAH | CAI | 120.5° | 121.5° |
CAG | CAH | H3 | 119.7° | 119.3° |
CAH | CAG | H4 | 120.1° | 120.0° |
CAF | CAE | CAD | 120.8° | 120.5° |
CAF | CAE | CAJ | 119.9° | 120.1° |
CAH | CAI | CAJ | 119.3° | 120.1° |
CAH | CAI | H2 | 120.4° | 120.0° |
CAI | CAH | H3 | 119.8° | 119.2° |
CAC | CAD | CAE | 119.3° | 119.4° |
CAC | CAD | CAN | 120.6° | 121.9° |
CAD | CAC | H5 | 119.9° | 119.8° |
CAD | CAE | CAJ | 119.2° | 119.4° |
CAE | CAD | CAN | 120.1° | 118.6° |
CAE | CAJ | CAI | 120.6° | 119.1° |
CAE | CAJ | CAK | 119.1° | 118.8° |
CAD | CAN | OAO | 120.7° | 119.8° |
CAD | CAN | NAM | 119.6° | 120.4° |
CAI | CAJ | CAK | 120.3° | 122.1° |
CAJ | CAI | H2 | 120.4° | 119.9° |
CAJ | CAK | NAM | 120.9° | 120.3° |
CAJ | CAK | OAL | 119.4° | 119.8° |
OAO | CAN | NAM | 119.6° | 119.8° |
CAN | NAM | CAK | 121.0° | 122.5° |
CAN | NAM | OAX | 119.6° | 118.8° |
NAM | CAK | OAL | 119.7° | 119.9° |
CAK | NAM | OAX | 119.4° | 118.8° |
NAM | OAX | H1 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAU | CAV | CAW | H10 | 180.0° | 179.7° |
CAV | CAU | CAT | H9 | 180.0° | 180.0° |
CAU | CAV | CAW | CAR | 0.2° | 0.6° |
CAV | CAU | CAT | CAS | 0.4° | 0.1° |
CAV | CAU | CAT | H8 | 179.6° | 180.0° |
CAU | CAV | CAW | H11 | 179.8° | 180.0° |
CAW | CAV | CAU | CAT | 0.7° | 0.3° |
CAV | CAW | CAR | H11 | 180.0° | 179.4° |
CAV | CAW | CAR | CAS | 0.7° | 0.6° |
CAV | CAW | CAR | CAP | 178.9° | 179.7° |
CAW | CAV | CAU | H9 | 179.3° | 179.8° |
CAU | CAT | CAS | H8 | 180.0° | 179.9° |
CAU | CAT | CAS | CAR | 0.5° | 0.1° |
CAU | CAT | CAS | H7 | 179.6° | 180.0° |
CAT | CAU | CAV | H10 | 179.3° | 180.0° |
CAW | CAR | CAS | CAT | 1.0° | 0.3° |
CAW | CAR | CAS | CAP | 178.1° | 179.7° |
CAW | CAR | CAP | OAQ | 37.4° | 174.2° |
CAW | CAR | CAP | CAA | 140.1° | 5.8° |
CAW | CAR | CAS | H7 | 179.1° | 179.7° |
CAR | CAW | CAV | H10 | 179.8° | 179.7° |
CAT | CAS | CAR | H7 | 180.0° | 180.0° |
CAT | CAS | CAR | CAP | 179.1° | 179.9° |
CAS | CAT | CAU | H9 | 179.7° | 179.9° |
CAS | CAR | CAP | OAQ | 140.8° | 5.4° |
CAS | CAR | CAP | CAA | 41.7° | 174.5° |
CAR | CAS | CAT | H8 | 179.6° | 180.0° |
CAS | CAR | CAW | H11 | 179.4° | 180.0° |
CAR | CAP | OAQ | CAA | 177.4° | 180.0° |
CAR | CAP | CAA | CAB | 36.9° | 104.3° |
CAR | CAP | CAA | CAF | 145.2° | 76.2° |
CAP | CAR | CAS | H7 | 0.9° | 0.0° |
CAP | CAR | CAW | H11 | 1.1° | 0.4° |
OAQ | CAP | CAA | CAB | 140.5° | 75.8° |
OAQ | CAP | CAA | CAF | 37.4° | 103.7° |
CAP | CAA | CAB | CAF | 177.9° | 179.5° |
CAP | CAA | CAB | CAC | 179.5° | 180.0° |
CAP | CAA | CAF | CAG | 0.9° | 0.0° |
CAP | CAA | CAF | CAE | 178.6° | 180.0° |
CAP | CAA | CAB | H6 | 0.5° | 0.2° |
CAA | CAB | CAC | H6 | 180.0° | 179.7° |
CAB | CAA | CAF | CAG | 178.9° | 179.5° |
CAB | CAA | CAF | CAE | 0.6° | 0.5° |
CAA | CAB | CAC | CAD | 1.4° | 0.3° |
CAA | CAB | CAC | H5 | 178.6° | 179.7° |
CAF | CAA | CAB | CAC | 1.6° | 0.6° |
CAA | CAF | CAG | CAE | 179.5° | 180.0° |
CAA | CAF | CAG | CAH | 179.7° | 180.0° |
CAA | CAF | CAE | CAD | 0.5° | 0.3° |
CAA | CAF | CAE | CAJ | 179.2° | 180.0° |
CAA | CAF | CAG | H4 | 0.3° | 0.0° |
CAF | CAA | CAB | H6 | 178.5° | 179.7° |
CAB | CAC | CAD | H5 | 180.0° | 180.0° |
CAB | CAC | CAD | CAE | 0.3° | 0.0° |
CAB | CAC | CAD | CAN | 179.5° | 179.7° |
CAF | CAG | CAH | H4 | 180.0° | 180.0° |
CAF | CAG | CAH | CAI | 0.6° | 0.1° |
CAG | CAF | CAE | CAD | 180.0° | 179.8° |
CAG | CAF | CAE | CAJ | 1.3° | 0.0° |
CAF | CAG | CAH | H3 | 179.4° | 180.0° |
CAH | CAG | CAF | CAE | 0.8° | 0.0° |
CAG | CAH | CAI | H3 | 180.0° | 179.9° |
CAG | CAH | CAI | CAJ | 0.9° | 0.1° |
CAG | CAH | CAI | H2 | 179.1° | 180.0° |
CAF | CAE | CAD | CAC | 0.7° | 0.0° |
CAF | CAE | CAD | CAJ | 178.7° | 179.7° |
CAF | CAE | CAD | CAN | 179.6° | 179.7° |
CAF | CAE | CAJ | CAI | 1.6° | 0.0° |
CAF | CAE | CAJ | CAK | 179.9° | 180.0° |
CAE | CAF | CAG | H4 | 179.2° | 180.0° |
CAH | CAI | CAJ | CAE | 1.4° | 0.1° |
CAH | CAI | CAJ | H2 | 180.0° | 179.9° |
CAH | CAI | CAJ | CAK | 179.9° | 179.9° |
CAI | CAH | CAG | H4 | 179.4° | 180.0° |
CAC | CAD | CAE | CAN | 179.7° | 179.7° |
CAC | CAD | CAE | CAJ | 179.4° | 179.7° |
CAC | CAD | CAN | OAO | 0.1° | 0.0° |
CAC | CAD | CAN | NAM | 179.9° | 179.8° |
CAD | CAC | CAB | H6 | 178.6° | 180.0° |
CAD | CAE | CAJ | CAI | 179.7° | 179.7° |
CAD | CAE | CAJ | CAK | 1.2° | 0.3° |
CAE | CAD | CAN | OAO | 179.9° | 179.8° |
CAE | CAD | CAN | NAM | 0.1° | 0.5° |
CAE | CAD | CAC | H5 | 179.7° | 180.0° |
CAJ | CAE | CAD | CAN | 0.9° | 0.5° |
CAE | CAJ | CAI | CAK | 178.5° | 180.0° |
CAE | CAJ | CAK | NAM | 0.7° | 0.0° |
CAE | CAJ | CAK | OAL | 179.4° | 180.0° |
CAE | CAJ | CAI | H2 | 178.6° | 180.0° |
CAD | CAN | OAO | NAM | 180.0° | 179.7° |
CAD | CAN | NAM | CAK | 0.3° | 0.2° |
CAD | CAN | NAM | OAX | 179.4° | 179.7° |
CAN | CAD | CAC | H5 | 0.5° | 0.3° |
CAI | CAJ | CAK | NAM | 179.3° | 180.0° |
CAI | CAJ | CAK | OAL | 0.9° | 0.0° |
CAJ | CAI | CAH | H3 | 179.1° | 179.9° |
CAJ | CAK | NAM | CAN | 0.0° | 0.1° |
CAJ | CAK | NAM | OAL | 179.9° | 180.0° |
CAJ | CAK | NAM | OAX | 179.1° | 180.0° |
CAK | CAJ | CAI | H2 | 0.1° | 0.0° |
OAO | CAN | NAM | CAK | 179.7° | 179.9° |
OAO | CAN | NAM | OAX | 0.6° | 0.0° |
CAN | NAM | CAK | OAX | 179.1° | 179.9° |
CAN | NAM | CAK | OAL | 179.9° | 180.0° |
CAN | NAM | OAX | H1 | 179.5° | 179.9° |
CAK | NAM | OAX | H1 | 0.4° | 0.0° |
OAL | CAK | NAM | OAX | 0.8° | 0.1° |
H2 | CAI | CAH | H3 | 0.9° | 0.1° |
H3 | CAH | CAG | H4 | 0.6° | 0.0° |
H5 | CAC | CAB | H6 | 1.4° | 0.0° |
H7 | CAS | CAT | H8 | 0.4° | 0.1° |
H8 | CAT | CAU | H9 | 0.4° | 0.0° |
H9 | CAU | CAV | H10 | 0.7° | 0.0° |
H10 | CAV | CAW | H11 | 0.2° | 0.3° |