L7Z
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C16 | C09 | sing | 1.53Å | 1.57Å | |
O14 | C10 | doub | 1.21Å | 1.21Å | |
C10 | C09 | sing | 1.51Å | 1.36Å | |
C10 | C11 | sing | 1.51Å | 1.61Å | |
C09 | C08 | sing | 1.53Å | 1.53Å | |
C09 | C13 | sing | 1.51Å | 1.69Å | |
C04 | C03 | doub | 1.38Å | 1.51Å | Aromatic |
C04 | C05 | sing | 1.38Å | 1.54Å | Aromatic |
C08 | C05 | sing | 1.51Å | 1.56Å | |
C03 | C02 | sing | 1.38Å | 1.52Å | Aromatic |
C05 | C06 | doub | 1.38Å | 1.52Å | Aromatic |
C13 | O15 | doub | 1.21Å | 1.18Å | |
C13 | C12 | sing | 1.52Å | 1.34Å | |
C11 | C12 | sing | 1.54Å | 1.55Å | |
C02 | C07 | sing | 1.51Å | 1.52Å | |
C02 | C01 | doub | 1.38Å | 1.52Å | Aromatic |
C06 | C01 | sing | 1.38Å | 1.54Å | Aromatic |
C01 | H1 | sing | 1.08Å | 1.08Å | |
C03 | H2 | sing | 1.08Å | 1.08Å | |
C04 | H3 | sing | 1.08Å | 1.08Å | |
C06 | H4 | sing | 1.08Å | 1.08Å | |
C07 | H5 | sing | 1.09Å | 1.10Å | |
C07 | H6 | sing | 1.09Å | 1.10Å | |
C07 | H7 | sing | 1.09Å | 1.10Å | |
C08 | H8 | sing | 1.09Å | 1.10Å | |
C08 | H9 | sing | 1.09Å | 1.10Å | |
C11 | H10 | sing | 1.09Å | 1.10Å | |
C11 | H11 | sing | 1.09Å | 1.10Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C12 | H13 | sing | 1.09Å | 1.10Å | |
C16 | H14 | sing | 1.09Å | 1.10Å | |
C16 | H15 | sing | 1.09Å | 1.10Å | |
C16 | H16 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C16 | C09 | C10 | 109.5° | 109.8° |
C16 | C09 | C08 | 110.7° | 109.8° |
C16 | C09 | C13 | 116.2° | 110.0° |
C09 | C16 | H14 | 109.5° | 109.4° |
C09 | C16 | H15 | 109.4° | 109.4° |
C09 | C16 | H16 | 109.5° | 109.5° |
O14 | C10 | C09 | 132.5° | 126.3° |
O14 | C10 | C11 | 125.2° | 126.4° |
C09 | C10 | C11 | 102.3° | 107.3° |
C10 | C09 | C08 | 113.9° | 109.8° |
C10 | C09 | C13 | 108.4° | 107.6° |
C10 | C11 | C12 | 105.0° | 105.5° |
C10 | C11 | H10 | 110.6° | 110.2° |
C10 | C11 | H11 | 110.6° | 110.2° |
C08 | C09 | C13 | 97.7° | 109.8° |
C09 | C08 | C05 | 116.3° | 109.5° |
C09 | C08 | H8 | 107.7° | 109.5° |
C09 | C08 | H9 | 107.7° | 109.5° |
C09 | C13 | O15 | 126.6° | 127.0° |
C09 | C13 | C12 | 107.0° | 106.0° |
C03 | C04 | C05 | 121.1° | 120.0° |
C04 | C03 | C02 | 118.6° | 120.0° |
C04 | C03 | H2 | 120.7° | 120.0° |
C03 | C04 | H3 | 119.4° | 120.0° |
C04 | C05 | C08 | 121.3° | 120.0° |
C04 | C05 | C06 | 119.6° | 120.0° |
C05 | C04 | H3 | 119.5° | 120.0° |
C08 | C05 | C06 | 119.0° | 120.0° |
C05 | C08 | H8 | 107.8° | 109.5° |
C05 | C08 | H9 | 107.7° | 109.5° |
C03 | C02 | C07 | 117.7° | 120.0° |
C03 | C02 | C01 | 121.5° | 120.0° |
C02 | C03 | H2 | 120.7° | 120.0° |
C05 | C06 | C01 | 119.4° | 120.0° |
C05 | C06 | H4 | 120.3° | 120.0° |
O15 | C13 | C12 | 126.3° | 127.0° |
C13 | C12 | C11 | 106.1° | 104.6° |
C13 | C12 | H12 | 110.3° | 110.5° |
C13 | C12 | H13 | 110.3° | 110.4° |
C12 | C11 | H10 | 110.6° | 110.3° |
C12 | C11 | H11 | 110.6° | 110.2° |
C11 | C12 | H12 | 110.3° | 110.4° |
C11 | C12 | H13 | 110.3° | 110.3° |
C07 | C02 | C01 | 120.8° | 120.0° |
C02 | C07 | H5 | 109.5° | 109.4° |
C02 | C07 | H6 | 109.5° | 109.5° |
C02 | C07 | H7 | 109.5° | 109.5° |
C02 | C01 | C06 | 119.7° | 120.0° |
C02 | C01 | H1 | 120.1° | 120.0° |
C06 | C01 | H1 | 120.1° | 120.0° |
C01 | C06 | H4 | 120.3° | 120.0° |
H5 | C07 | H6 | 109.5° | 109.4° |
H5 | C07 | H7 | 109.5° | 109.5° |
H6 | C07 | H7 | 109.5° | 109.5° |
H8 | C08 | H9 | 109.5° | 109.4° |
H10 | C11 | H11 | 109.5° | 110.3° |
H12 | C12 | H13 | 109.5° | 110.5° |
H14 | C16 | H15 | 109.5° | 109.5° |
H14 | C16 | H16 | 109.5° | 109.4° |
H15 | C16 | H16 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C16 | C09 | C10 | O14 | 30.8° | 60.0° |
C16 | C09 | C10 | C08 | 124.6° | 120.8° |
C16 | C09 | C10 | C13 | 127.7° | 119.7° |
C16 | C09 | C10 | C11 | 149.6° | 119.7° |
C16 | C09 | C08 | C13 | 121.8° | 121.0° |
C16 | C09 | C08 | C05 | 73.5° | 59.2° |
C16 | C09 | C13 | O15 | 56.6° | 42.2° |
C16 | C09 | C13 | C12 | 127.2° | 137.8° |
C16 | C09 | C08 | H8 | 165.6° | 60.9° |
C16 | C09 | C08 | H9 | 47.5° | 179.2° |
C09 | C16 | H14 | H15 | 120.0° | 119.9° |
C09 | C16 | H14 | H16 | 120.0° | 120.0° |
C09 | C16 | H15 | H16 | 120.0° | 120.1° |
O14 | C10 | C09 | C11 | 179.6° | 179.6° |
O14 | C10 | C09 | C08 | 93.8° | 60.8° |
O14 | C10 | C09 | C13 | 158.5° | 179.7° |
O14 | C10 | C11 | C12 | 147.4° | 162.5° |
O14 | C10 | C11 | H10 | 28.1° | 78.5° |
O14 | C10 | C11 | H11 | 93.3° | 43.5° |
C10 | C09 | C08 | C13 | 114.2° | 118.1° |
C10 | C09 | C08 | C05 | 162.6° | 180.0° |
C10 | C09 | C13 | O15 | 179.6° | 161.8° |
C10 | C09 | C13 | C12 | 3.4° | 18.2° |
C09 | C10 | C11 | C12 | 32.9° | 17.9° |
C10 | C09 | C08 | H8 | 41.6° | 60.0° |
C10 | C09 | C08 | H9 | 76.5° | 60.0° |
C09 | C10 | C11 | H10 | 152.2° | 101.2° |
C09 | C10 | C11 | H11 | 86.3° | 136.9° |
C10 | C09 | C16 | H14 | 180.0° | 59.3° |
C10 | C09 | C16 | H15 | 60.0° | 179.3° |
C10 | C09 | C16 | H16 | 60.0° | 60.6° |
C11 | C10 | C09 | C08 | 85.8° | 119.5° |
C11 | C10 | C09 | C13 | 21.9° | 0.0° |
C10 | C11 | C12 | C13 | 31.7° | 28.9° |
C10 | C11 | C12 | H10 | 119.3° | 119.0° |
C10 | C11 | C12 | H11 | 119.3° | 118.9° |
C10 | C11 | H10 | H11 | 122.1° | 121.9° |
C10 | C11 | C12 | H12 | 151.1° | 90.0° |
C10 | C11 | C12 | H13 | 87.8° | 147.6° |
C09 | C08 | C05 | C04 | 48.6° | 90.0° |
C09 | C08 | C05 | H8 | 121.0° | 120.0° |
C09 | C08 | C05 | H9 | 121.0° | 120.0° |
C09 | C08 | C05 | C06 | 133.0° | 89.7° |
C08 | C09 | C13 | O15 | 61.1° | 78.7° |
C08 | C09 | C13 | C12 | 115.1° | 101.3° |
C09 | C08 | H8 | H9 | 116.9° | 120.0° |
C08 | C09 | C16 | H14 | 53.5° | 179.8° |
C08 | C09 | C16 | H15 | 66.5° | 59.9° |
C08 | C09 | C16 | H16 | 173.5° | 60.2° |
C13 | C09 | C08 | C05 | 48.4° | 61.9° |
C09 | C13 | O15 | C12 | 175.5° | 180.0° |
C09 | C13 | C12 | C11 | 18.1° | 28.9° |
C13 | C09 | C08 | H8 | 72.6° | 178.1° |
C13 | C09 | C08 | H9 | 169.3° | 58.2° |
C09 | C13 | C12 | H12 | 137.6° | 89.9° |
C09 | C13 | C12 | H13 | 101.4° | 147.6° |
C13 | C09 | C16 | H14 | 56.7° | 58.9° |
C13 | C09 | C16 | H15 | 176.8° | 61.0° |
C13 | C09 | C16 | H16 | 63.3° | 178.9° |
C03 | C04 | C05 | H3 | 180.0° | 179.9° |
C03 | C04 | C05 | C08 | 178.9° | 180.0° |
C04 | C03 | C02 | H2 | 180.0° | 179.9° |
C03 | C04 | C05 | C06 | 0.5° | 0.3° |
C04 | C03 | C02 | C07 | 179.6° | 180.0° |
C04 | C03 | C02 | C01 | 0.3° | 0.0° |
C04 | C05 | C08 | C06 | 178.4° | 179.7° |
C05 | C04 | C03 | C02 | 0.4° | 0.1° |
C04 | C05 | C06 | C01 | 0.4° | 0.6° |
C05 | C04 | C03 | H2 | 179.6° | 179.9° |
C04 | C05 | C06 | H4 | 179.6° | 180.0° |
C04 | C05 | C08 | H8 | 169.6° | 150.0° |
C04 | C05 | C08 | H9 | 72.4° | 30.1° |
C08 | C05 | C06 | C01 | 178.8° | 179.7° |
C08 | C05 | C04 | H3 | 1.1° | 0.1° |
C08 | C05 | C06 | H4 | 1.2° | 0.3° |
C05 | C08 | H8 | H9 | 116.9° | 120.0° |
C03 | C02 | C07 | C01 | 179.9° | 180.0° |
C03 | C02 | C01 | C06 | 0.2° | 0.3° |
C03 | C02 | C01 | H1 | 179.8° | 180.0° |
C02 | C03 | C04 | H3 | 179.5° | 179.9° |
C03 | C02 | C07 | H5 | 90.0° | 90.0° |
C03 | C02 | C07 | H6 | 149.9° | 29.9° |
C03 | C02 | C07 | H7 | 30.0° | 150.0° |
C05 | C06 | C01 | C02 | 0.3° | 0.6° |
C05 | C06 | C01 | H4 | 180.0° | 179.4° |
C05 | C06 | C01 | H1 | 179.7° | 179.7° |
C06 | C05 | C04 | H3 | 179.5° | 179.8° |
C06 | C05 | C08 | H8 | 12.1° | 30.3° |
C06 | C05 | C08 | H9 | 106.0° | 150.3° |
O15 | C13 | C12 | C11 | 158.1° | 151.1° |
O15 | C13 | C12 | H12 | 38.6° | 90.1° |
O15 | C13 | C12 | H13 | 82.4° | 32.4° |
C13 | C12 | C11 | H12 | 119.5° | 118.9° |
C13 | C12 | C11 | H13 | 119.5° | 118.8° |
C13 | C12 | C11 | H10 | 150.9° | 90.1° |
C13 | C12 | C11 | H11 | 87.6° | 147.8° |
C13 | C12 | H12 | H13 | 121.6° | 122.4° |
C12 | C11 | H10 | H11 | 122.1° | 122.0° |
C11 | C12 | H12 | H13 | 121.6° | 122.3° |
C07 | C02 | C01 | C06 | 179.6° | 179.7° |
C07 | C02 | C01 | H1 | 0.4° | 0.0° |
C07 | C02 | C03 | H2 | 0.4° | 0.1° |
C02 | C07 | H5 | H6 | 120.0° | 120.0° |
C02 | C07 | H5 | H7 | 120.0° | 120.0° |
C02 | C07 | H6 | H7 | 120.0° | 120.0° |
C02 | C01 | C06 | H1 | 180.0° | 179.7° |
C01 | C02 | C03 | H2 | 179.7° | 179.9° |
C02 | C01 | C06 | H4 | 179.7° | 180.0° |
C01 | C02 | C07 | H5 | 90.1° | 90.0° |
C01 | C02 | C07 | H6 | 29.9° | 150.0° |
C01 | C02 | C07 | H7 | 149.9° | 30.0° |
H1 | C01 | C06 | H4 | 0.3° | 0.2° |
H2 | C03 | C04 | H3 | 0.4° | 0.0° |
H5 | C07 | H6 | H7 | 120.0° | 120.0° |
H10 | C11 | C12 | H12 | 89.6° | 151.0° |
H10 | C11 | C12 | H13 | 31.5° | 28.6° |
H11 | C11 | C12 | H12 | 31.8° | 29.0° |
H11 | C11 | C12 | H13 | 152.9° | 93.4° |
H14 | C16 | H15 | H16 | 120.0° | 120.0° |