W6Y
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
OAC | CAW | doub | 1.22Å | 1.22Å | |
CAW | NAO | sing | 1.34Å | 1.39Å | |
CAW | NAP | sing | 1.34Å | 1.38Å | |
NAO | CAV | sing | 1.38Å | 1.41Å | |
OAF | CAR | doub | 1.21Å | 1.25Å | |
OAB | CAR | sing | 1.35Å | 1.25Å | |
CAR | CAV | sing | 1.48Å | 1.41Å | |
NAP | CAX | sing | 1.35Å | 1.39Å | |
CAV | CAU | doub | 1.36Å | 1.42Å | |
CAX | CAU | sing | 1.47Å | 1.41Å | |
CAX | OAD | doub | 1.22Å | 1.24Å | |
CAU | CAN | sing | 1.51Å | 1.40Å | |
CAN | CAM | sing | 1.53Å | 1.55Å | |
OAA | CAQ | doub | 1.22Å | 1.24Å | |
CAI | CAK | doub | 1.36Å | 1.40Å | Aromatic |
CAI | CAS | sing | 1.39Å | 1.39Å | Aromatic |
CAM | CAS | sing | 1.51Å | 1.36Å | |
CAK | CAZ | sing | 1.40Å | 1.42Å | Aromatic |
CAS | CAL | doub | 1.36Å | 1.40Å | Aromatic |
CAQ | CAT | sing | 1.47Å | 1.39Å | |
CAQ | OAE | sing | 1.35Å | 1.26Å | |
CAZ | CAT | doub | 1.46Å | 1.42Å | Aromatic |
CAZ | CAY | sing | 1.42Å | 1.40Å | Aromatic |
CAL | CAY | sing | 1.41Å | 1.41Å | Aromatic |
CAT | CAH | sing | 1.39Å | 1.41Å | Aromatic |
CAY | CAJ | doub | 1.40Å | 1.41Å | Aromatic |
CAH | CAG | doub | 1.39Å | 1.40Å | Aromatic |
CAJ | CAG | sing | 1.36Å | 1.40Å | Aromatic |
OAE | H1 | sing | 0.97Å | 0.95Å | |
CAH | H2 | sing | 1.08Å | 1.08Å | |
CAG | H3 | sing | 1.08Å | 1.08Å | |
CAJ | H4 | sing | 1.08Å | 1.08Å | |
CAL | H5 | sing | 1.08Å | 1.08Å | |
CAK | H6 | sing | 1.08Å | 1.08Å | |
CAI | H7 | sing | 1.08Å | 1.08Å | |
CAM | H8 | sing | 1.09Å | 1.10Å | |
CAM | H9 | sing | 1.09Å | 1.10Å | |
CAN | H10 | sing | 1.09Å | 1.10Å | |
CAN | H11 | sing | 1.09Å | 1.10Å | |
NAP | H12 | sing | 0.97Å | 1.00Å | |
NAO | H13 | sing | 0.97Å | 1.00Å | |
OAB | H14 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
OAC | CAW | NAO | 121.2° | 119.1° |
OAC | CAW | NAP | 118.5° | 119.1° |
NAO | CAW | NAP | 120.3° | 121.8° |
CAW | NAO | CAV | 120.3° | 121.2° |
CAW | NAO | H13 | 119.9° | 119.4° |
CAW | NAP | CAX | 121.2° | 120.4° |
CAW | NAP | H12 | 119.4° | 119.8° |
NAO | CAV | CAR | 115.9° | 120.3° |
NAO | CAV | CAU | 118.9° | 119.4° |
CAV | NAO | H13 | 119.8° | 119.4° |
OAF | CAR | OAB | 118.4° | 120.0° |
OAF | CAR | CAV | 119.1° | 120.0° |
OAB | CAR | CAV | 122.5° | 120.0° |
CAR | OAB | H14 | 109.5° | 117.0° |
CAR | CAV | CAU | 125.2° | 120.3° |
NAP | CAX | CAU | 119.6° | 118.8° |
NAP | CAX | OAD | 116.3° | 120.6° |
CAX | NAP | H12 | 119.4° | 119.8° |
CAV | CAU | CAX | 119.8° | 118.4° |
CAV | CAU | CAN | 121.1° | 120.8° |
CAU | CAX | OAD | 124.1° | 120.5° |
CAX | CAU | CAN | 119.1° | 120.8° |
CAU | CAN | CAM | 111.3° | 109.5° |
CAU | CAN | H10 | 109.0° | 109.5° |
CAU | CAN | H11 | 109.0° | 109.4° |
CAN | CAM | CAS | 110.3° | 109.4° |
CAN | CAM | H8 | 109.3° | 109.5° |
CAN | CAM | H9 | 109.3° | 109.5° |
CAM | CAN | H10 | 109.0° | 109.5° |
CAM | CAN | H11 | 109.0° | 109.5° |
OAA | CAQ | CAT | 117.6° | 120.0° |
OAA | CAQ | OAE | 121.4° | 120.0° |
CAK | CAI | CAS | 119.4° | 120.9° |
CAI | CAK | CAZ | 121.9° | 119.6° |
CAI | CAK | H6 | 119.1° | 120.2° |
CAK | CAI | H7 | 120.3° | 119.6° |
CAI | CAS | CAM | 120.2° | 119.5° |
CAI | CAS | CAL | 119.5° | 121.0° |
CAS | CAI | H7 | 120.3° | 119.5° |
CAM | CAS | CAL | 120.3° | 119.5° |
CAS | CAM | H8 | 109.2° | 109.5° |
CAS | CAM | H9 | 109.3° | 109.5° |
CAK | CAZ | CAT | 123.4° | 121.5° |
CAK | CAZ | CAY | 118.2° | 119.6° |
CAZ | CAK | H6 | 119.0° | 120.2° |
CAS | CAL | CAY | 121.7° | 119.6° |
CAS | CAL | H5 | 119.1° | 120.2° |
CAT | CAQ | OAE | 121.0° | 120.0° |
CAQ | CAT | CAZ | 121.7° | 120.7° |
CAQ | CAT | CAH | 116.9° | 120.7° |
CAQ | OAE | H1 | 109.5° | 117.0° |
CAT | CAZ | CAY | 118.4° | 118.9° |
CAZ | CAT | CAH | 121.4° | 118.6° |
CAZ | CAY | CAL | 119.4° | 119.2° |
CAZ | CAY | CAJ | 120.0° | 119.4° |
CAL | CAY | CAJ | 120.7° | 121.3° |
CAY | CAL | H5 | 119.2° | 120.2° |
CAT | CAH | CAG | 119.7° | 120.5° |
CAT | CAH | H2 | 120.1° | 119.7° |
CAY | CAJ | CAG | 121.3° | 120.7° |
CAY | CAJ | H4 | 119.3° | 119.7° |
CAH | CAG | CAJ | 119.2° | 121.9° |
CAG | CAH | H2 | 120.1° | 119.7° |
CAH | CAG | H3 | 120.4° | 119.1° |
CAJ | CAG | H3 | 120.4° | 119.0° |
CAG | CAJ | H4 | 119.4° | 119.7° |
H8 | CAM | H9 | 109.5° | 109.5° |
H10 | CAN | H11 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
OAC | CAW | NAO | NAP | 179.1° | 179.8° |
OAC | CAW | NAO | CAV | 179.5° | 180.0° |
OAC | CAW | NAP | CAX | 179.0° | 179.7° |
OAC | CAW | NAP | H12 | 1.0° | 0.3° |
OAC | CAW | NAO | H13 | 0.5° | 0.2° |
CAW | NAO | CAV | H13 | 180.0° | 179.8° |
CAW | NAO | CAV | CAR | 179.9° | 180.0° |
NAO | CAW | NAP | CAX | 0.1° | 0.0° |
CAW | NAO | CAV | CAU | 1.0° | 0.6° |
NAO | CAW | NAP | H12 | 179.9° | 180.0° |
NAP | CAW | NAO | CAV | 0.4° | 0.2° |
CAW | NAP | CAX | H12 | 180.0° | 180.0° |
CAW | NAP | CAX | CAU | 0.1° | 0.0° |
CAW | NAP | CAX | OAD | 179.6° | 180.0° |
NAP | CAW | NAO | H13 | 179.5° | 180.0° |
NAO | CAV | CAR | OAF | 48.5° | 174.0° |
NAO | CAV | CAR | OAB | 129.8° | 6.1° |
NAO | CAV | CAR | CAU | 178.8° | 179.4° |
NAO | CAV | CAU | CAX | 0.9° | 0.6° |
NAO | CAV | CAU | CAN | 179.1° | 179.8° |
OAF | CAR | OAB | CAV | 178.4° | 180.0° |
OAF | CAR | CAV | CAU | 130.3° | 6.6° |
OAF | CAR | OAB | H14 | 0.0° | 0.1° |
OAB | CAR | CAV | CAU | 51.3° | 173.4° |
CAR | CAV | CAU | CAX | 179.7° | 180.0° |
CAR | CAV | CAU | CAN | 0.3° | 0.3° |
CAR | CAV | NAO | H13 | 0.1° | 0.2° |
CAV | CAR | OAB | H14 | 178.4° | 180.0° |
NAP | CAX | CAU | CAV | 0.4° | 0.3° |
NAP | CAX | CAU | OAD | 179.8° | 180.0° |
NAP | CAX | CAU | CAN | 179.7° | 180.0° |
CAV | CAU | CAX | CAN | 180.0° | 179.7° |
CAV | CAU | CAX | OAD | 179.9° | 179.7° |
CAV | CAU | CAN | CAM | 113.6° | 89.9° |
CAV | CAU | CAN | H10 | 6.7° | 30.1° |
CAV | CAU | CAN | H11 | 126.1° | 150.1° |
CAU | CAV | NAO | H13 | 179.0° | 179.6° |
CAX | CAU | CAN | CAM | 66.5° | 89.8° |
CAX | CAU | CAN | H10 | 173.3° | 150.2° |
CAX | CAU | CAN | H11 | 53.8° | 30.2° |
CAU | CAX | NAP | H12 | 179.9° | 180.0° |
OAD | CAX | CAU | CAN | 0.1° | 0.0° |
OAD | CAX | NAP | H12 | 0.4° | 0.0° |
CAU | CAN | CAM | H10 | 120.3° | 120.0° |
CAU | CAN | CAM | H11 | 120.3° | 120.0° |
CAU | CAN | CAM | CAS | 66.6° | 180.0° |
CAU | CAN | CAM | H8 | 173.3° | 60.0° |
CAU | CAN | CAM | H9 | 53.6° | 60.0° |
CAU | CAN | H10 | H11 | 119.2° | 120.0° |
CAN | CAM | CAS | CAI | 94.7° | 90.0° |
CAN | CAM | CAS | H8 | 120.1° | 120.0° |
CAN | CAM | CAS | H9 | 120.1° | 120.0° |
CAN | CAM | CAS | CAL | 87.4° | 91.2° |
CAN | CAM | H8 | H9 | 119.6° | 120.0° |
CAM | CAN | H10 | H11 | 119.2° | 120.0° |
OAA | CAQ | CAT | OAE | 179.5° | 179.7° |
OAA | CAQ | CAT | CAZ | 140.0° | 8.0° |
OAA | CAQ | CAT | CAH | 39.6° | 172.2° |
OAA | CAQ | OAE | H1 | 0.0° | 0.0° |
CAK | CAI | CAS | H7 | 180.0° | 179.1° |
CAK | CAI | CAS | CAM | 179.1° | 180.0° |
CAI | CAK | CAZ | H6 | 180.0° | 180.0° |
CAK | CAI | CAS | CAL | 1.2° | 1.2° |
CAI | CAK | CAZ | CAT | 179.1° | 180.0° |
CAI | CAK | CAZ | CAY | 0.2° | 0.3° |
CAI | CAS | CAM | CAL | 177.9° | 178.8° |
CAS | CAI | CAK | CAZ | 0.9° | 0.9° |
CAI | CAS | CAL | CAY | 0.8° | 0.9° |
CAI | CAS | CAL | H5 | 179.2° | 179.1° |
CAS | CAI | CAK | H6 | 179.1° | 179.1° |
CAI | CAS | CAM | H8 | 145.2° | 150.0° |
CAI | CAS | CAM | H9 | 25.4° | 30.0° |
CAM | CAS | CAL | CAY | 178.7° | 179.7° |
CAM | CAS | CAL | H5 | 1.3° | 0.3° |
CAM | CAS | CAI | H7 | 0.9° | 0.9° |
CAS | CAM | H8 | H9 | 119.6° | 120.0° |
CAS | CAM | CAN | H10 | 53.7° | 60.0° |
CAS | CAM | CAN | H11 | 173.1° | 60.0° |
CAK | CAZ | CAT | CAQ | 0.6° | 0.0° |
CAK | CAZ | CAT | CAY | 179.3° | 179.7° |
CAK | CAZ | CAY | CAL | 0.2° | 0.0° |
CAK | CAZ | CAT | CAH | 179.9° | 179.8° |
CAK | CAZ | CAY | CAJ | 179.1° | 179.7° |
CAZ | CAK | CAI | H7 | 179.1° | 180.0° |
CAS | CAL | CAY | CAZ | 0.1° | 0.3° |
CAS | CAL | CAY | H5 | 180.0° | 180.0° |
CAS | CAL | CAY | CAJ | 179.4° | 180.0° |
CAL | CAS | CAI | H7 | 178.9° | 179.7° |
CAL | CAS | CAM | H8 | 32.8° | 28.8° |
CAL | CAS | CAM | H9 | 152.5° | 148.8° |
CAQ | CAT | CAZ | CAH | 179.5° | 179.8° |
CAQ | CAT | CAZ | CAY | 179.9° | 179.7° |
CAQ | CAT | CAH | CAG | 179.4° | 180.0° |
CAT | CAQ | OAE | H1 | 179.5° | 179.7° |
CAQ | CAT | CAH | H2 | 0.6° | 0.0° |
OAE | CAQ | CAT | CAZ | 40.5° | 171.6° |
OAE | CAQ | CAT | CAH | 140.0° | 8.1° |
CAT | CAZ | CAY | CAL | 179.5° | 179.7° |
CAT | CAZ | CAY | CAJ | 0.2° | 0.6° |
CAZ | CAT | CAH | CAG | 1.1° | 0.3° |
CAZ | CAT | CAH | H2 | 178.9° | 179.7° |
CAT | CAZ | CAK | H6 | 0.9° | 0.0° |
CAZ | CAY | CAL | CAJ | 179.3° | 179.7° |
CAY | CAZ | CAT | CAH | 0.6° | 0.6° |
CAZ | CAY | CAJ | CAG | 0.7° | 0.3° |
CAZ | CAY | CAJ | H4 | 179.3° | 179.7° |
CAZ | CAY | CAL | H5 | 179.9° | 179.7° |
CAY | CAZ | CAK | H6 | 179.8° | 179.7° |
CAL | CAY | CAJ | CAG | 180.0° | 180.0° |
CAL | CAY | CAJ | H4 | 0.0° | 0.0° |
CAT | CAH | CAG | H2 | 180.0° | 180.0° |
CAT | CAH | CAG | CAJ | 0.6° | 0.0° |
CAT | CAH | CAG | H3 | 179.4° | 180.0° |
CAY | CAJ | CAG | CAH | 0.3° | 0.0° |
CAY | CAJ | CAG | H4 | 180.0° | 180.0° |
CAY | CAJ | CAG | H3 | 179.7° | 180.0° |
CAJ | CAY | CAL | H5 | 0.6° | 0.0° |
CAH | CAG | CAJ | H3 | 180.0° | 180.0° |
CAH | CAG | CAJ | H4 | 179.7° | 180.0° |
CAJ | CAG | CAH | H2 | 179.4° | 180.0° |
H2 | CAH | CAG | H3 | 0.6° | 0.0° |
H3 | CAG | CAJ | H4 | 0.3° | 0.0° |
H6 | CAK | CAI | H7 | 0.9° | 0.0° |
H8 | CAM | CAN | H10 | 66.4° | NaN° |
H8 | CAM | CAN | H11 | 53.0° | 60.0° |
H9 | CAM | CAN | H10 | 173.8° | 60.0° |
H9 | CAM | CAN | H11 | 66.7° | 180.0° |