AE9
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | CAO | sing | 1.43Å | 1.45Å | |
CAO | CAM | sing | 1.53Å | 1.53Å | |
CAM | NAS | sing | 1.46Å | 1.47Å | |
NAS | NAT | doub | 1.12Å | 1.12Å | |
NAT | NAC | doub | 1.12Å | 1.13Å | |
O1 | H1 | sing | 0.97Å | 0.95Å | |
CAO | HAO1 | sing | 1.09Å | 1.10Å | |
CAO | HAO2 | sing | 1.09Å | 1.10Å | |
CAM | HAM1 | sing | 1.09Å | 1.10Å | |
CAM | HAM2 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | CAO | CAM | 103.8° | 109.4° |
CAO | O1 | H1 | 109.5° | 114.0° |
O1 | CAO | HAO1 | 111.4° | 109.5° |
O1 | CAO | HAO2 | 112.6° | 109.5° |
CAO | CAM | NAS | 103.0° | 109.5° |
CAM | CAO | HAO1 | 111.4° | 109.5° |
CAM | CAO | HAO2 | 112.6° | 109.5° |
CAO | CAM | HAM1 | 111.7° | 109.5° |
CAO | CAM | HAM2 | 113.1° | 109.5° |
CAM | NAS | NAT | 177.2° | 120.0° |
NAS | CAM | HAM1 | 111.7° | 109.5° |
NAS | CAM | HAM2 | 113.1° | 109.5° |
NAS | NAT | NAC | 179.9° | 179.9° |
HAO1 | CAO | HAO2 | 105.2° | 109.5° |
HAM1 | CAM | HAM2 | 104.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | CAO | CAM | HAO1 | 120.0° | 120.0° |
O1 | CAO | CAM | HAO2 | 122.1° | 120.0° |
O1 | CAO | CAM | NAS | 6.4° | 65.0° |
O1 | CAO | HAO1 | HAO2 | 122.3° | 120.0° |
O1 | CAO | CAM | HAM1 | 113.6° | 55.1° |
O1 | CAO | CAM | HAM2 | 128.8° | 175.0° |
CAO | CAM | NAS | HAM1 | 120.0° | 120.0° |
CAO | CAM | NAS | HAM2 | 122.4° | 120.0° |
CAO | CAM | NAS | NAT | 93.4° | 120.0° |
CAM | CAO | O1 | H1 | 135.3° | 180.0° |
CAM | CAO | HAO1 | HAO2 | 122.3° | 120.0° |
CAO | CAM | HAM1 | HAM2 | 122.6° | 119.9° |
CAM | NAS | NAT | NAC | 104.8° | 10.7° |
NAS | CAM | CAO | HAO1 | 126.4° | 175.0° |
NAS | CAM | CAO | HAO2 | 115.7° | 55.0° |
NAS | CAM | HAM1 | HAM2 | 122.6° | 120.0° |
NAT | NAS | CAM | HAM1 | 146.6° | 120.0° |
NAT | NAS | CAM | HAM2 | 29.0° | 0.0° |
H1 | O1 | CAO | HAO1 | 104.7° | 60.0° |
H1 | O1 | CAO | HAO2 | 13.2° | 60.0° |
HAO1 | CAO | CAM | HAM1 | 6.4° | 64.9° |
HAO1 | CAO | CAM | HAM2 | 111.2° | 55.0° |
HAO2 | CAO | CAM | HAM1 | 124.3° | 175.0° |
HAO2 | CAO | CAM | HAM2 | 6.7° | 65.0° |