N07
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C20 | C19 | sing | 1.53Å | 1.54Å | |
C20 | C21 | sing | 1.53Å | 1.54Å | |
C19 | N18 | sing | 1.47Å | 1.46Å | |
C21 | C22 | sing | 1.53Å | 1.52Å | |
N18 | C23 | sing | 1.47Å | 1.45Å | |
N18 | C16 | sing | 1.35Å | 1.46Å | |
O17 | C16 | doub | 1.22Å | 1.24Å | |
C22 | C23 | sing | 1.53Å | 1.53Å | |
C16 | C15 | sing | 1.48Å | 1.59Å | |
C15 | C24 | doub | 1.39Å | 1.41Å | Aromatic |
C15 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
C24 | C11 | sing | 1.39Å | 1.42Å | Aromatic |
C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
C09 | C08 | doub | 1.38Å | 1.41Å | Aromatic |
C09 | C10 | sing | 1.39Å | 1.41Å | Aromatic |
C11 | C10 | sing | 1.48Å | 1.50Å | |
C11 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
C13 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
C08 | C07 | sing | 1.38Å | 1.40Å | Aromatic |
C10 | C25 | doub | 1.39Å | 1.41Å | Aromatic |
C07 | C06 | doub | 1.40Å | 1.41Å | Aromatic |
C25 | C06 | sing | 1.39Å | 1.41Å | Aromatic |
C06 | C05 | sing | 1.48Å | 1.46Å | |
C05 | O26 | sing | 1.35Å | 1.38Å | Aromatic |
C05 | N04 | doub | 1.31Å | 1.37Å | Aromatic |
O26 | C02 | sing | 1.34Å | 1.38Å | Aromatic |
N04 | N03 | sing | 1.29Å | 1.37Å | Aromatic |
C02 | N03 | doub | 1.30Å | 1.36Å | Aromatic |
C02 | C01 | sing | 1.51Å | 1.50Å | |
C01 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C07 | H4 | sing | 1.08Å | 1.08Å | |
C08 | H5 | sing | 1.08Å | 1.08Å | |
C09 | H6 | sing | 1.08Å | 1.08Å | |
C12 | H7 | sing | 1.08Å | 1.08Å | |
C13 | H8 | sing | 1.08Å | 1.08Å | |
C14 | H9 | sing | 1.08Å | 1.08Å | |
C19 | H10 | sing | 1.09Å | 1.10Å | |
C19 | H11 | sing | 1.09Å | 1.10Å | |
C20 | H12 | sing | 1.09Å | 1.10Å | |
C20 | H13 | sing | 1.09Å | 1.10Å | |
C21 | H14 | sing | 1.09Å | 1.10Å | |
C21 | H15 | sing | 1.09Å | 1.10Å | |
C22 | H16 | sing | 1.09Å | 1.10Å | |
C22 | H17 | sing | 1.09Å | 1.10Å | |
C23 | H18 | sing | 1.09Å | 1.10Å | |
C23 | H19 | sing | 1.09Å | 1.10Å | |
C24 | H20 | sing | 1.08Å | 1.08Å | |
C25 | H21 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C19 | C20 | C21 | 110.2° | 109.3° |
C20 | C19 | N18 | 108.6° | 108.8° |
C20 | C19 | H10 | 109.7° | 109.6° |
C20 | C19 | H11 | 109.7° | 109.6° |
C19 | C20 | H12 | 109.3° | 109.4° |
C19 | C20 | H13 | 109.3° | 109.5° |
C20 | C21 | C22 | 110.4° | 109.6° |
C21 | C20 | H12 | 109.3° | 109.5° |
C21 | C20 | H13 | 109.3° | 109.5° |
C20 | C21 | H14 | 109.3° | 109.5° |
C20 | C21 | H15 | 109.3° | 109.5° |
C19 | N18 | C23 | 110.9° | 118.8° |
C19 | N18 | C16 | 127.8° | 120.6° |
N18 | C19 | H10 | 109.7° | 109.6° |
N18 | C19 | H11 | 109.7° | 109.6° |
C21 | C22 | C23 | 110.1° | 109.3° |
C22 | C21 | H14 | 109.2° | 109.5° |
C22 | C21 | H15 | 109.2° | 109.4° |
C21 | C22 | H16 | 109.3° | 109.5° |
C21 | C22 | H17 | 109.3° | 109.5° |
C23 | N18 | C16 | 121.3° | 120.6° |
N18 | C23 | C22 | 108.8° | 108.8° |
N18 | C23 | H18 | 109.6° | 109.6° |
N18 | C23 | H19 | 109.6° | 109.6° |
N18 | C16 | O17 | 115.6° | 120.0° |
N18 | C16 | C15 | 133.8° | 120.0° |
O17 | C16 | C15 | 110.6° | 120.0° |
C23 | C22 | H16 | 109.3° | 109.5° |
C23 | C22 | H17 | 109.3° | 109.5° |
C22 | C23 | H18 | 109.7° | 109.4° |
C22 | C23 | H19 | 109.6° | 109.8° |
C16 | C15 | C24 | 125.6° | 120.1° |
C16 | C15 | C14 | 119.2° | 120.1° |
C24 | C15 | C14 | 115.2° | 119.8° |
C15 | C24 | C11 | 121.9° | 119.7° |
C15 | C24 | H20 | 119.1° | 120.1° |
C15 | C14 | C13 | 124.9° | 120.1° |
C15 | C14 | H9 | 117.5° | 119.9° |
C24 | C11 | C10 | 120.5° | 120.0° |
C24 | C11 | C12 | 120.1° | 119.9° |
C11 | C24 | H20 | 119.0° | 120.1° |
C14 | C13 | C12 | 118.5° | 120.3° |
C14 | C13 | H8 | 120.8° | 119.9° |
C13 | C14 | H9 | 117.5° | 120.0° |
C08 | C09 | C10 | 120.3° | 120.1° |
C09 | C08 | C07 | 120.2° | 120.3° |
C09 | C08 | H5 | 119.9° | 119.9° |
C08 | C09 | H6 | 119.9° | 120.0° |
C09 | C10 | C11 | 120.2° | 120.1° |
C09 | C10 | C25 | 119.3° | 119.9° |
C10 | C09 | H6 | 119.8° | 119.9° |
C10 | C11 | C12 | 119.4° | 120.1° |
C11 | C10 | C25 | 120.5° | 120.0° |
C11 | C12 | C13 | 119.4° | 120.2° |
C11 | C12 | H7 | 120.3° | 119.9° |
C13 | C12 | H7 | 120.3° | 119.9° |
C12 | C13 | H8 | 120.8° | 119.9° |
C08 | C07 | C06 | 119.9° | 120.1° |
C08 | C07 | H4 | 120.0° | 120.0° |
C07 | C08 | H5 | 119.9° | 119.8° |
C10 | C25 | C06 | 120.3° | 119.7° |
C10 | C25 | H21 | 119.9° | 120.1° |
C07 | C06 | C25 | 120.1° | 119.8° |
C07 | C06 | C05 | 120.1° | 120.1° |
C06 | C07 | H4 | 120.1° | 119.9° |
C25 | C06 | C05 | 119.9° | 120.1° |
C06 | C25 | H21 | 119.9° | 120.1° |
C06 | C05 | O26 | 127.1° | 126.3° |
C06 | C05 | N04 | 127.0° | 126.4° |
O26 | C05 | N04 | 105.8° | 107.2° |
C05 | O26 | C02 | 109.7° | 106.3° |
C05 | N04 | N03 | 108.9° | 109.3° |
O26 | C02 | N03 | 106.2° | 107.6° |
O26 | C02 | C01 | 126.3° | 126.2° |
N04 | N03 | C02 | 109.3° | 109.5° |
N03 | C02 | C01 | 127.4° | 126.2° |
C02 | C01 | H1 | 109.5° | 109.4° |
C02 | C01 | H2 | 109.5° | 109.5° |
C02 | C01 | H3 | 109.5° | 109.5° |
H1 | C01 | H2 | 109.5° | 109.4° |
H1 | C01 | H3 | 109.5° | 109.5° |
H2 | C01 | H3 | 109.5° | 109.5° |
H10 | C19 | H11 | 109.5° | 109.6° |
H12 | C20 | H13 | 109.4° | 109.5° |
H14 | C21 | H15 | 109.5° | 109.4° |
H16 | C22 | H17 | 109.4° | 109.6° |
H18 | C23 | H19 | 109.5° | 109.7° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C19 | C20 | C21 | H12 | 120.1° | 119.9° |
C19 | C20 | C21 | H13 | 120.1° | 120.0° |
C20 | C19 | N18 | H10 | 119.9° | 119.8° |
C20 | C19 | N18 | H11 | 119.9° | 119.9° |
C19 | C20 | C21 | C22 | 53.2° | 61.3° |
C20 | C19 | N18 | C23 | 64.9° | 53.6° |
C20 | C19 | N18 | C16 | 115.1° | 126.7° |
C20 | C19 | H10 | H11 | 120.4° | 120.3° |
C19 | C20 | H12 | H13 | 119.7° | 120.1° |
C19 | C20 | C21 | H14 | 66.9° | 178.6° |
C19 | C20 | C21 | H15 | 173.4° | 58.7° |
C21 | C20 | C19 | N18 | 58.0° | 54.6° |
C20 | C21 | C22 | H14 | 120.1° | 120.0° |
C20 | C21 | C22 | H15 | 120.2° | 120.0° |
C20 | C21 | C22 | C23 | 53.3° | 61.3° |
C21 | C20 | C19 | H10 | 177.8° | 174.4° |
C21 | C20 | C19 | H11 | 61.9° | 65.3° |
C21 | C20 | H12 | H13 | 119.7° | 120.1° |
C20 | C21 | H14 | H15 | 119.6° | 120.0° |
C20 | C21 | C22 | H16 | 173.4° | 58.6° |
C20 | C21 | C22 | H17 | 66.8° | 178.7° |
C19 | N18 | C23 | C16 | 180.0° | 179.7° |
C19 | N18 | C16 | O17 | 0.4° | 175.9° |
C19 | N18 | C23 | C22 | 65.2° | 53.6° |
C19 | N18 | C16 | C15 | 179.5° | 4.1° |
N18 | C19 | H10 | H11 | 120.4° | 120.4° |
N18 | C19 | C20 | H12 | 178.1° | 65.3° |
N18 | C19 | C20 | H13 | 62.2° | 174.6° |
C19 | N18 | C23 | H18 | 174.9° | 65.9° |
C19 | N18 | C23 | H19 | 54.6° | 173.7° |
C21 | C22 | C23 | N18 | 58.5° | 54.6° |
C21 | C22 | C23 | H16 | 120.1° | 119.9° |
C21 | C22 | C23 | H17 | 120.1° | 119.9° |
C22 | C21 | C20 | H12 | 173.4° | 58.6° |
C22 | C21 | C20 | H13 | 66.9° | 178.7° |
C22 | C21 | H14 | H15 | 119.5° | 119.9° |
C21 | C22 | H16 | H17 | 119.7° | 120.1° |
C21 | C22 | C23 | H18 | 178.4° | 65.1° |
C21 | C22 | C23 | H19 | 61.3° | 174.6° |
C23 | N18 | C16 | O17 | 179.6° | 3.8° |
N18 | C23 | C22 | H18 | 119.9° | 119.7° |
N18 | C23 | C22 | H19 | 119.9° | 120.0° |
C23 | N18 | C16 | C15 | 0.5° | 176.2° |
C23 | N18 | C19 | H10 | 175.2° | 173.4° |
C23 | N18 | C19 | H11 | 54.9° | 66.3° |
N18 | C23 | C22 | H16 | 178.6° | 65.3° |
N18 | C23 | C22 | H17 | 61.6° | 174.5° |
N18 | C23 | H18 | H19 | 120.3° | 120.4° |
N18 | C16 | O17 | C15 | 179.3° | 179.9° |
C16 | N18 | C23 | C22 | 114.8° | 126.7° |
N18 | C16 | C15 | C24 | 170.9° | 129.6° |
N18 | C16 | C15 | C14 | 9.9° | 51.1° |
C16 | N18 | C19 | H10 | 4.8° | 6.9° |
C16 | N18 | C19 | H11 | 125.1° | 113.4° |
C16 | N18 | C23 | H18 | 5.1° | 113.8° |
C16 | N18 | C23 | H19 | 125.4° | 6.6° |
O17 | C16 | C15 | C24 | 10.0° | 50.4° |
O17 | C16 | C15 | C14 | 169.1° | 129.0° |
C23 | C22 | C21 | H14 | 66.8° | 178.6° |
C23 | C22 | C21 | H15 | 173.5° | 58.7° |
C23 | C22 | H16 | H17 | 119.7° | 120.1° |
C22 | C23 | H18 | H19 | 120.3° | 120.4° |
C16 | C15 | C24 | C14 | 179.2° | 179.4° |
C16 | C15 | C24 | C11 | 179.3° | 180.0° |
C16 | C15 | C14 | C13 | 179.5° | 179.7° |
C16 | C15 | C14 | H9 | 0.6° | 0.4° |
C16 | C15 | C24 | H20 | 0.7° | 0.6° |
C15 | C24 | C11 | H20 | 180.0° | 179.4° |
C24 | C15 | C14 | C13 | 0.2° | 0.3° |
C15 | C24 | C11 | C10 | 179.6° | 179.7° |
C15 | C24 | C11 | C12 | 0.1° | 0.6° |
C24 | C15 | C14 | H9 | 179.8° | 179.7° |
C14 | C15 | C24 | C11 | 0.1° | 0.6° |
C15 | C14 | C13 | H9 | 180.0° | 179.9° |
C15 | C14 | C13 | C12 | 0.1° | 0.0° |
C15 | C14 | C13 | H8 | 179.9° | 180.0° |
C14 | C15 | C24 | H20 | 179.9° | 180.0° |
C24 | C11 | C10 | C09 | 10.2° | 0.3° |
C24 | C11 | C10 | C12 | 179.5° | 179.7° |
C24 | C11 | C12 | C13 | 0.2° | 0.3° |
C24 | C11 | C10 | C25 | 170.2° | 180.0° |
C24 | C11 | C12 | H7 | 179.8° | 179.7° |
C14 | C13 | C12 | C11 | 0.1° | 0.0° |
C14 | C13 | C12 | H8 | 180.0° | 180.0° |
C14 | C13 | C12 | H7 | 179.9° | 180.0° |
C08 | C09 | C10 | H6 | 180.0° | 180.0° |
C08 | C09 | C10 | C11 | 179.8° | 180.0° |
C09 | C08 | C07 | H5 | 180.0° | 180.0° |
C08 | C09 | C10 | C25 | 0.2° | 0.3° |
C09 | C08 | C07 | C06 | 0.1° | 0.1° |
C09 | C08 | C07 | H4 | 179.9° | 180.0° |
C09 | C10 | C11 | C25 | 179.6° | 179.7° |
C09 | C10 | C11 | C12 | 169.3° | NaN° |
C10 | C09 | C08 | C07 | 0.1° | 0.0° |
C09 | C10 | C25 | C06 | 0.1° | 0.6° |
C10 | C09 | C08 | H5 | 179.8° | 180.0° |
C09 | C10 | C25 | H21 | 179.8° | 180.0° |
C10 | C11 | C12 | C13 | 179.6° | 180.0° |
C11 | C10 | C25 | C06 | 179.8° | 179.7° |
C11 | C10 | C09 | H6 | 0.2° | 0.0° |
C10 | C11 | C12 | H7 | 0.3° | 0.0° |
C10 | C11 | C24 | H20 | 0.4° | 0.3° |
C11 | C10 | C25 | H21 | 0.2° | 0.3° |
C11 | C12 | C13 | H7 | 180.0° | 180.0° |
C12 | C11 | C10 | C25 | 10.3° | 0.3° |
C11 | C12 | C13 | H8 | 179.9° | 180.0° |
C12 | C11 | C24 | H20 | 179.9° | 180.0° |
C12 | C13 | C14 | H9 | 179.9° | 180.0° |
C08 | C07 | C06 | H4 | 180.0° | 179.9° |
C08 | C07 | C06 | C25 | 0.0° | 0.4° |
C08 | C07 | C06 | C05 | 180.0° | 180.0° |
C07 | C08 | C09 | H6 | 179.9° | 180.0° |
C10 | C25 | C06 | C07 | 0.1° | 0.7° |
C10 | C25 | C06 | H21 | 180.0° | 179.4° |
C10 | C25 | C06 | C05 | 180.0° | 179.7° |
C25 | C10 | C09 | H6 | 179.8° | 179.7° |
C07 | C06 | C25 | C05 | 180.0° | 179.6° |
C07 | C06 | C05 | O26 | 19.4° | 0.1° |
C07 | C06 | C05 | N04 | 160.3° | 179.5° |
C06 | C07 | C08 | H5 | 179.9° | 180.0° |
C07 | C06 | C25 | H21 | 179.9° | 180.0° |
C25 | C06 | C05 | O26 | 160.6° | 179.7° |
C25 | C06 | C05 | N04 | 19.7° | 0.9° |
C25 | C06 | C07 | H4 | 180.0° | 179.7° |
C06 | C05 | O26 | N04 | 179.8° | 179.5° |
C06 | C05 | O26 | C02 | 179.9° | 180.0° |
C06 | C05 | N04 | N03 | 179.9° | 179.8° |
C05 | C06 | C07 | H4 | 0.0° | 0.1° |
C05 | C06 | C25 | H21 | 0.1° | 0.3° |
O26 | C05 | N04 | N03 | 0.2° | 0.3° |
C05 | O26 | C02 | N03 | 0.0° | 0.4° |
C05 | O26 | C02 | C01 | 180.0° | 179.9° |
N04 | C05 | O26 | C02 | 0.1° | 0.4° |
C05 | N04 | N03 | C02 | 0.2° | 0.0° |
O26 | C02 | N03 | N04 | 0.1° | 0.2° |
O26 | C02 | N03 | C01 | 179.9° | 179.7° |
O26 | C02 | C01 | H1 | 0.0° | 90.2° |
O26 | C02 | C01 | H2 | 120.0° | 29.6° |
O26 | C02 | C01 | H3 | 120.0° | 149.7° |
N04 | N03 | C02 | C01 | 179.9° | 179.9° |
N03 | C02 | C01 | H1 | 179.9° | 90.1° |
N03 | C02 | C01 | H2 | 60.1° | 150.0° |
N03 | C02 | C01 | H3 | 59.9° | 30.0° |
C02 | C01 | H1 | H2 | 120.0° | 119.9° |
C02 | C01 | H1 | H3 | 120.0° | 120.0° |
C02 | C01 | H2 | H3 | 120.0° | 120.0° |
H1 | C01 | H2 | H3 | 120.0° | 120.1° |
H4 | C07 | C08 | H5 | 0.1° | 0.1° |
H5 | C08 | C09 | H6 | 0.2° | 0.0° |
H7 | C12 | C13 | H8 | 0.1° | 0.0° |
H8 | C13 | C14 | H9 | 0.1° | 0.0° |
H10 | C19 | C20 | H12 | 62.1° | 54.5° |
H10 | C19 | C20 | H13 | 57.7° | 65.6° |
H11 | C19 | C20 | H12 | 58.2° | 174.8° |
H11 | C19 | C20 | H13 | 178.0° | 54.7° |
H12 | C20 | C21 | H14 | 53.2° | 61.5° |
H12 | C20 | C21 | H15 | 66.5° | 178.6° |
H13 | C20 | C21 | H14 | 173.0° | 58.6° |
H13 | C20 | C21 | H15 | 53.3° | 61.3° |
H14 | C21 | C22 | H16 | 53.3° | 61.5° |
H14 | C21 | C22 | H17 | 173.1° | 58.7° |
H15 | C21 | C22 | H16 | 66.4° | 178.6° |
H15 | C21 | C22 | H17 | 53.4° | 61.3° |
H16 | C22 | C23 | H18 | 61.5° | 175.0° |
H16 | C22 | C23 | H19 | 58.8° | 54.7° |
H17 | C22 | C23 | H18 | 58.3° | 54.9° |
H17 | C22 | C23 | H19 | 178.5° | 65.5° |