7SL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C11 | O12 | sing | 1.34Å | 1.36Å | Aromatic |
C11 | C10 | doub | 1.35Å | 1.38Å | Aromatic |
O12 | C08 | sing | 1.35Å | 1.37Å | Aromatic |
O14 | C03 | doub | 1.22Å | 1.18Å | |
C10 | C09 | sing | 1.41Å | 1.36Å | Aromatic |
C08 | C09 | doub | 1.36Å | 1.38Å | Aromatic |
C08 | C07 | sing | 1.47Å | 1.53Å | |
C13 | C07 | doub | 1.37Å | 1.37Å | Aromatic |
C13 | C04 | sing | 1.41Å | 1.36Å | Aromatic |
C07 | N06 | sing | 1.37Å | 1.33Å | Aromatic |
C04 | C03 | sing | 1.48Å | 1.51Å | |
C04 | N05 | doub | 1.32Å | 1.32Å | Aromatic |
C03 | N02 | sing | 1.35Å | 1.44Å | |
N06 | N05 | sing | 1.28Å | 1.39Å | Aromatic |
N02 | C01 | sing | 1.46Å | 1.45Å | |
C10 | H1 | sing | 1.08Å | 1.08Å | |
C13 | H2 | sing | 1.08Å | 1.08Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C01 | H4 | sing | 1.09Å | 1.10Å | |
C01 | H5 | sing | 1.09Å | 1.10Å | |
C09 | H6 | sing | 1.08Å | 1.08Å | |
C11 | H7 | sing | 1.08Å | 1.08Å | |
N02 | H8 | sing | 0.97Å | 1.00Å | |
N06 | H9 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O12 | C11 | C10 | 107.8° | 108.7° |
C11 | O12 | C08 | 108.2° | 109.4° |
O12 | C11 | H7 | 126.1° | 125.7° |
C11 | C10 | C09 | 108.3° | 107.0° |
C11 | C10 | H1 | 125.9° | 126.5° |
C10 | C11 | H7 | 126.1° | 125.6° |
O12 | C08 | C09 | 107.9° | 108.1° |
O12 | C08 | C07 | 126.8° | 125.9° |
O14 | C03 | C04 | 119.7° | 120.0° |
O14 | C03 | N02 | 122.8° | 120.0° |
C10 | C09 | C08 | 107.9° | 106.7° |
C09 | C10 | H1 | 125.9° | 126.4° |
C10 | C09 | H6 | 126.0° | 126.7° |
C09 | C08 | C07 | 125.3° | 126.0° |
C08 | C09 | H6 | 126.1° | 126.6° |
C08 | C07 | C13 | 126.8° | 126.6° |
C08 | C07 | N06 | 125.4° | 126.6° |
C07 | C13 | C04 | 107.1° | 105.4° |
C13 | C07 | N06 | 107.8° | 106.7° |
C07 | C13 | H2 | 126.4° | 127.3° |
C13 | C04 | C03 | 126.1° | 126.3° |
C13 | C04 | N05 | 109.7° | 107.4° |
C04 | C13 | H2 | 126.5° | 127.3° |
C07 | N06 | N05 | 109.0° | 110.0° |
C07 | N06 | H9 | 125.5° | 125.0° |
C03 | C04 | N05 | 124.3° | 126.3° |
C04 | C03 | N02 | 117.5° | 120.0° |
C04 | N05 | N06 | 106.5° | 110.5° |
C03 | N02 | C01 | 120.8° | 120.0° |
C03 | N02 | H8 | 119.6° | 120.0° |
N05 | N06 | H9 | 125.5° | 125.0° |
N02 | C01 | H3 | 109.5° | 109.5° |
N02 | C01 | H4 | 109.4° | 109.5° |
N02 | C01 | H5 | 109.5° | 109.5° |
C01 | N02 | H8 | 119.6° | 120.0° |
H3 | C01 | H4 | 109.5° | 109.5° |
H3 | C01 | H5 | 109.5° | 109.4° |
H4 | C01 | H5 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O12 | C11 | C10 | H7 | 180.0° | 179.7° |
O12 | C11 | C10 | C09 | 0.7° | 0.0° |
C11 | O12 | C08 | C09 | 0.4° | 0.4° |
C11 | O12 | C08 | C07 | 179.5° | 180.0° |
O12 | C11 | C10 | H1 | 179.3° | 179.7° |
C10 | C11 | O12 | C08 | 0.2° | 0.3° |
C11 | C10 | C09 | H1 | 180.0° | 179.7° |
C11 | C10 | C09 | C08 | 0.9° | 0.3° |
C11 | C10 | C09 | H6 | 179.1° | 179.8° |
O12 | C08 | C09 | C10 | 0.8° | 0.4° |
O12 | C08 | C09 | C07 | 179.1° | 179.6° |
O12 | C08 | C07 | C13 | 6.8° | 0.5° |
O12 | C08 | C07 | N06 | 172.7° | 179.5° |
O12 | C08 | C09 | H6 | 179.2° | 179.6° |
C08 | O12 | C11 | H7 | 179.8° | 180.0° |
O14 | C03 | C04 | C13 | 18.9° | 0.1° |
O14 | C03 | C04 | N02 | 179.4° | 179.9° |
O14 | C03 | C04 | N05 | 160.3° | 180.0° |
O14 | C03 | N02 | C01 | 0.6° | 0.0° |
O14 | C03 | N02 | H8 | 179.4° | 179.9° |
C10 | C09 | C08 | H6 | 180.0° | 179.9° |
C10 | C09 | C08 | C07 | 179.9° | 180.0° |
C09 | C10 | C11 | H7 | 179.3° | 179.7° |
C09 | C08 | C07 | C13 | 174.3° | 180.0° |
C09 | C08 | C07 | N06 | 6.2° | 0.0° |
C08 | C09 | C10 | H1 | 179.1° | 179.9° |
C08 | C07 | C13 | N06 | 179.6° | 180.0° |
C08 | C07 | C13 | C04 | 179.9° | 180.0° |
C08 | C07 | N06 | N05 | 179.6° | 180.0° |
C08 | C07 | C13 | H2 | 0.1° | 0.2° |
C07 | C08 | C09 | H6 | 0.1° | 0.0° |
C08 | C07 | N06 | H9 | 0.4° | 0.0° |
C07 | C13 | C04 | H2 | 180.0° | 179.8° |
C07 | C13 | C04 | C03 | 179.7° | 180.0° |
C07 | C13 | C04 | N05 | 0.4° | 0.0° |
C13 | C07 | N06 | N05 | 0.0° | 0.0° |
C13 | C07 | N06 | H9 | 180.0° | 180.0° |
C04 | C13 | C07 | N06 | 0.3° | 0.0° |
C13 | C04 | C03 | N05 | 179.2° | 179.9° |
C13 | C04 | C03 | N02 | 161.7° | 180.0° |
C13 | C04 | N05 | N06 | 0.4° | 0.1° |
C07 | N06 | N05 | C04 | 0.3° | 0.0° |
C07 | N06 | N05 | H9 | 180.0° | 180.0° |
N06 | C07 | C13 | H2 | 179.8° | 179.8° |
C03 | C04 | N05 | N06 | 179.8° | 180.0° |
C04 | C03 | N02 | C01 | 180.0° | 180.0° |
C03 | C04 | C13 | H2 | 0.3° | 0.2° |
C04 | C03 | N02 | H8 | 0.0° | 0.0° |
N05 | C04 | C03 | N02 | 19.1° | 0.1° |
N05 | C04 | C13 | H2 | 179.6° | 179.7° |
C04 | N05 | N06 | H9 | 179.7° | 180.0° |
C03 | N02 | C01 | H8 | 180.0° | 180.0° |
C03 | N02 | C01 | H3 | 180.0° | 180.0° |
C03 | N02 | C01 | H4 | 60.0° | 60.0° |
C03 | N02 | C01 | H5 | 60.0° | 60.0° |
N02 | C01 | H3 | H4 | 120.0° | 120.0° |
N02 | C01 | H3 | H5 | 120.0° | 120.0° |
N02 | C01 | H4 | H5 | 120.0° | 120.0° |
H1 | C10 | C09 | H6 | 0.9° | 0.1° |
H1 | C10 | C11 | H7 | 0.7° | 0.1° |
H3 | C01 | H4 | H5 | 120.0° | 119.9° |
H3 | C01 | N02 | H8 | 0.0° | 0.1° |
H4 | C01 | N02 | H8 | 120.0° | 119.9° |
H5 | C01 | N02 | H8 | 120.0° | 120.0° |