L6N
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O3 | C3 | sing | 1.43Å | 1.40Å | |
C4 | O4 | sing | 1.43Å | 1.40Å | |
C4 | C3 | sing | 1.53Å | 1.53Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C3 | C2 | sing | 1.53Å | 1.53Å | |
C2 | O2 | sing | 1.43Å | 1.40Å | |
C2 | C1 | sing | 1.53Å | 1.53Å | |
C6 | C5 | sing | 1.53Å | 1.53Å | |
C6 | O6 | sing | 1.43Å | 1.40Å | |
CAM | O6 | sing | 1.43Å | 1.40Å | |
O5 | C5 | sing | 1.43Å | 1.40Å | |
O5 | C1 | sing | 1.43Å | 1.40Å | |
C1 | O1 | sing | 1.43Å | 1.40Å | |
C4 | H1 | sing | 1.09Å | 1.10Å | |
C5 | H2 | sing | 1.09Å | 1.10Å | |
C6 | H3 | sing | 1.09Å | 1.10Å | |
C6 | H4 | sing | 1.09Å | 1.10Å | |
C3 | H5 | sing | 1.09Å | 1.10Å | |
CAM | H6 | sing | 1.09Å | 1.10Å | |
CAM | H7 | sing | 1.09Å | 1.10Å | |
CAM | H8 | sing | 1.09Å | 1.10Å | |
C1 | H9 | sing | 1.09Å | 1.10Å | |
O1 | H10 | sing | 0.97Å | 0.95Å | |
C2 | H11 | sing | 1.09Å | 1.10Å | |
O2 | H12 | sing | 0.97Å | 0.95Å | |
O3 | H13 | sing | 0.97Å | 0.95Å | |
O4 | H14 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O3 | C3 | C4 | 108.7° | 109.6° |
O3 | C3 | C2 | 109.3° | 109.5° |
O3 | C3 | H5 | 110.4° | 109.6° |
C3 | O3 | H13 | 109.5° | 114.0° |
O4 | C4 | C3 | 109.0° | 109.5° |
O4 | C4 | C5 | 108.7° | 109.5° |
O4 | C4 | H1 | 110.4° | 109.5° |
C4 | O4 | H14 | 109.5° | 114.0° |
C3 | C4 | C5 | 111.5° | 109.2° |
C4 | C3 | C2 | 111.1° | 109.0° |
C3 | C4 | H1 | 108.6° | 109.5° |
C4 | C3 | H5 | 108.6° | 109.5° |
C4 | C5 | C6 | 107.6° | 109.5° |
C4 | C5 | O5 | 110.3° | 109.4° |
C5 | C4 | H1 | 108.6° | 109.5° |
C4 | C5 | H2 | 109.3° | 109.4° |
C3 | C2 | O2 | 109.0° | 109.5° |
C3 | C2 | C1 | 110.1° | 109.2° |
C2 | C3 | H5 | 108.6° | 109.5° |
C3 | C2 | H11 | 108.9° | 109.5° |
O2 | C2 | C1 | 109.2° | 109.5° |
O2 | C2 | H11 | 110.8° | 109.5° |
C2 | O2 | H12 | 109.5° | 114.0° |
C2 | C1 | O5 | 109.7° | 109.4° |
C2 | C1 | O1 | 109.6° | 109.5° |
C2 | C1 | H9 | 108.3° | 109.5° |
C1 | C2 | H11 | 108.9° | 109.6° |
C5 | C6 | O6 | 111.2° | 109.5° |
C6 | C5 | O5 | 109.0° | 109.5° |
C6 | C5 | H2 | 109.3° | 109.5° |
C5 | C6 | H3 | 109.0° | 109.5° |
C5 | C6 | H4 | 109.0° | 109.5° |
C6 | O6 | CAM | 112.6° | 114.0° |
O6 | C6 | H3 | 109.1° | 109.5° |
O6 | C6 | H4 | 109.0° | 109.5° |
O6 | CAM | H6 | 109.5° | 109.4° |
O6 | CAM | H7 | 109.5° | 109.5° |
O6 | CAM | H8 | 109.5° | 109.5° |
C5 | O5 | C1 | 113.0° | 114.1° |
O5 | C5 | H2 | 111.2° | 109.5° |
O5 | C1 | O1 | 109.1° | 109.5° |
O5 | C1 | H9 | 110.1° | 109.5° |
O1 | C1 | H9 | 110.1° | 109.5° |
C1 | O1 | H10 | 109.5° | 114.0° |
H3 | C6 | H4 | 109.5° | 109.4° |
H6 | CAM | H7 | 109.4° | 109.5° |
H6 | CAM | H8 | 109.5° | 109.5° |
H7 | CAM | H8 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O3 | C3 | C4 | O4 | 72.8° | 63.2° |
O3 | C3 | C4 | C2 | 120.4° | 119.9° |
O3 | C3 | C4 | H5 | 120.2° | 120.3° |
O3 | C3 | C4 | C5 | 167.2° | 176.8° |
O3 | C3 | C2 | H5 | 120.5° | 120.3° |
O3 | C3 | C2 | O2 | 71.8° | 63.3° |
O3 | C3 | C2 | C1 | 168.5° | 176.8° |
O3 | C3 | C4 | H1 | 47.5° | 56.9° |
O3 | C3 | C2 | H11 | 49.1° | 56.9° |
O4 | C4 | C3 | C5 | 120.0° | 120.0° |
O4 | C4 | C3 | H1 | 120.3° | 120.1° |
O4 | C4 | C5 | H1 | 120.2° | 120.1° |
O4 | C4 | C3 | C2 | 166.8° | 176.9° |
O4 | C4 | C5 | C6 | 68.3° | 62.5° |
O4 | C4 | C5 | O5 | 172.9° | 177.5° |
O4 | C4 | C5 | H2 | 50.3° | 57.6° |
O4 | C4 | C3 | H5 | 47.4° | 57.1° |
C3 | C4 | C5 | H1 | 119.7° | 119.9° |
C4 | C3 | C2 | H5 | 119.4° | 119.8° |
C4 | C3 | C2 | O2 | 168.1° | 176.8° |
C4 | C3 | C2 | C1 | 48.4° | 57.0° |
C3 | C4 | C5 | C6 | 171.5° | 177.6° |
C3 | C4 | C5 | O5 | 52.7° | 57.6° |
C3 | C4 | C5 | H2 | 69.8° | 62.4° |
C4 | C3 | C2 | H11 | 70.9° | 63.0° |
C4 | C3 | O3 | H13 | 180.0° | 179.9° |
C3 | C4 | O4 | H14 | 180.0° | 60.0° |
C5 | C4 | C3 | C2 | 46.8° | 56.9° |
C4 | C5 | C6 | O5 | 119.6° | 120.0° |
C4 | C5 | C6 | H2 | 118.6° | 120.0° |
C4 | C5 | C6 | O6 | 175.8° | 175.0° |
C4 | C5 | O5 | H2 | 121.4° | 119.9° |
C4 | C5 | O5 | C1 | 63.5° | 61.1° |
C4 | C5 | C6 | H3 | 63.9° | 55.0° |
C4 | C5 | C6 | H4 | 55.6° | 65.0° |
C5 | C4 | C3 | H5 | 72.6° | 62.9° |
C5 | C4 | O4 | H14 | 58.3° | 179.7° |
C3 | C2 | O2 | C1 | 120.3° | 119.7° |
C3 | C2 | O2 | H11 | 119.8° | 120.1° |
C3 | C2 | C1 | H11 | 119.4° | 119.9° |
C3 | C2 | C1 | O5 | 56.6° | 57.6° |
C3 | C2 | C1 | O1 | 176.4° | 177.6° |
C2 | C3 | C4 | H1 | 72.9° | 63.0° |
C3 | C2 | C1 | H9 | 63.5° | 62.4° |
C3 | C2 | O2 | H12 | 180.0° | 180.0° |
C2 | C3 | O3 | H13 | 58.5° | 60.5° |
O2 | C2 | C1 | H11 | 121.1° | 120.2° |
O2 | C2 | C1 | O5 | 176.2° | 177.5° |
O2 | C2 | C1 | O1 | 64.0° | 62.6° |
O2 | C2 | C3 | H5 | 48.7° | 57.0° |
O2 | C2 | C1 | H9 | 56.1° | 57.5° |
C2 | C1 | O5 | C5 | 65.7° | 61.2° |
C2 | C1 | O5 | O1 | 120.1° | 120.0° |
C2 | C1 | O5 | H9 | 119.1° | 120.0° |
C2 | C1 | O1 | H9 | 119.0° | 120.0° |
C1 | C2 | C3 | H5 | 71.0° | 62.9° |
C2 | C1 | O1 | H10 | 180.0° | 179.9° |
C1 | C2 | O2 | H12 | 59.7° | 60.4° |
C5 | C6 | O6 | H3 | 120.3° | 120.0° |
C5 | C6 | O6 | H4 | 120.2° | 120.0° |
C5 | C6 | O6 | CAM | 155.6° | 180.0° |
C6 | C5 | O5 | H2 | 120.6° | 120.1° |
C6 | C5 | O5 | C1 | 178.6° | 178.9° |
C6 | C5 | C4 | H1 | 51.8° | 57.7° |
C5 | C6 | H3 | H4 | 119.2° | 120.0° |
O6 | C6 | C5 | O5 | 56.2° | 65.0° |
O6 | C6 | C5 | H2 | 65.5° | 55.0° |
O6 | C6 | H3 | H4 | 119.2° | 120.0° |
C6 | O6 | CAM | H6 | 180.0° | 180.0° |
C6 | O6 | CAM | H7 | 60.0° | 60.0° |
C6 | O6 | CAM | H8 | 60.0° | 60.0° |
CAM | O6 | C6 | H3 | 84.1° | 60.0° |
CAM | O6 | C6 | H4 | 35.4° | 60.0° |
O6 | CAM | H6 | H7 | 120.0° | 120.0° |
O6 | CAM | H6 | H8 | 120.0° | 120.0° |
O6 | CAM | H7 | H8 | 120.0° | 120.0° |
C5 | O5 | C1 | O1 | 174.2° | 178.9° |
O5 | C5 | C4 | H1 | 66.9° | 62.3° |
O5 | C5 | C6 | H3 | 176.5° | 174.9° |
O5 | C5 | C6 | H4 | 64.1° | 55.0° |
C5 | O5 | C1 | H9 | 53.3° | 58.8° |
O5 | C1 | O1 | H9 | 120.9° | 120.0° |
C1 | O5 | C5 | H2 | 58.0° | 58.8° |
O5 | C1 | O1 | H10 | 59.8° | 60.0° |
O5 | C1 | C2 | H11 | 62.7° | 62.3° |
O1 | C1 | C2 | H11 | 57.1° | 57.6° |
H1 | C4 | C5 | H2 | 170.5° | 177.7° |
H1 | C4 | C3 | H5 | 167.7° | 177.1° |
H1 | C4 | O4 | H14 | 60.7° | 60.1° |
H2 | C5 | C6 | H3 | 54.8° | 65.0° |
H2 | C5 | C6 | H4 | 174.2° | 175.0° |
H5 | C3 | C2 | H11 | 169.6° | 177.1° |
H5 | C3 | O3 | H13 | 60.9° | 59.7° |
H6 | CAM | H7 | H8 | 120.0° | 120.0° |
H9 | C1 | O1 | H10 | 61.0° | 60.0° |
H9 | C1 | C2 | H11 | 177.1° | 177.7° |
H11 | C2 | O2 | H12 | 60.2° | 59.8° |