HA7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | N1 | doub | 0.00Å | 1.33Å | |
C1 | C2 | sing | 0.00Å | 1.38Å | |
N1 | O1 | sing | 0.00Å | 1.45Å | |
O1 | C6 | sing | 0.00Å | 1.38Å | |
C2 | C6 | doub | 0.00Å | 1.39Å | |
N2 | C5 | sing | 0.00Å | 1.48Å | |
N2 | HN2 | sing | 0.00Å | 1.00Å | |
C3 | C2 | sing | 0.00Å | 1.52Å | |
C3 | C4 | sing | 0.00Å | 1.53Å | |
C3 | H3 | sing | 0.00Å | 1.10Å | |
C3 | H3A | sing | 0.00Å | 1.10Å | |
O3 | HO3 | sing | 0.00Å | 0.95Å | |
C4 | N2 | sing | 0.00Å | 1.48Å | |
C4 | H4 | sing | 0.00Å | 1.10Å | |
C4 | H4A | sing | 0.00Å | 1.10Å | |
O4 | C1 | sing | 0.00Å | 1.23Å | |
C5 | C7 | sing | 0.00Å | 1.52Å | |
C5 | H5 | sing | 0.00Å | 1.10Å | |
C6 | C5 | sing | 0.00Å | 1.54Å | |
C7 | O2 | doub | 0.00Å | 1.25Å | |
C7 | O3 | sing | 0.00Å | 1.25Å | |
O4 | H8 | sing | 0.00Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N1 | C1 | C2 | 110.4° | 90.0° |
C1 | N1 | O1 | 107.0° | 90.0° |
N1 | C1 | O4 | 125.9° | 90.0° |
C1 | C2 | C6 | 107.7° | 90.0° |
C1 | C2 | C3 | 127.5° | 90.0° |
C2 | C1 | O4 | 123.8° | 90.0° |
N1 | O1 | C6 | 107.0° | 90.0° |
O1 | C6 | C2 | 107.9° | 90.0° |
O1 | C6 | C5 | 132.8° | 90.0° |
C6 | C2 | C3 | 124.7° | 90.0° |
C2 | C6 | C5 | 119.2° | 90.0° |
C5 | N2 | HN2 | 108.2° | 90.0° |
C5 | N2 | C4 | 113.2° | 90.0° |
N2 | C5 | C7 | 109.7° | 90.0° |
N2 | C5 | H5 | 108.2° | 90.0° |
N2 | C5 | C6 | 112.6° | 90.0° |
HN2 | N2 | C4 | 108.3° | 90.0° |
C2 | C3 | C4 | 107.6° | 90.0° |
C2 | C3 | H3 | 110.1° | 90.0° |
C2 | C3 | H3A | 110.1° | 90.0° |
C4 | C3 | H3 | 110.1° | 90.0° |
C4 | C3 | H3A | 110.1° | 90.0° |
C3 | C4 | N2 | 109.8° | 90.0° |
C3 | C4 | H4 | 109.4° | 90.0° |
C3 | C4 | H4A | 109.3° | 90.0° |
H3 | C3 | H3A | 108.8° | 90.0° |
HO3 | O3 | C7 | 109.5° | 90.0° |
N2 | C4 | H4 | 109.4° | 90.0° |
N2 | C4 | H4A | 109.3° | 90.0° |
H4 | C4 | H4A | 109.6° | 90.0° |
C1 | O4 | H8 | 109.5° | 90.0° |
C7 | C5 | H5 | 108.4° | 90.0° |
C7 | C5 | C6 | 112.5° | 90.0° |
C5 | C7 | O2 | 117.1° | 90.0° |
C5 | C7 | O3 | 115.7° | 90.0° |
H5 | C5 | C6 | 105.2° | 90.0° |
O2 | C7 | O3 | 127.2° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N1 | C1 | C2 | O4 | 179.7° | 90.0° |
C1 | N1 | O1 | C6 | 0.5° | 90.0° |
N1 | C1 | C2 | C6 | 0.1° | 90.0° |
N1 | C1 | C2 | C3 | 179.5° | 90.0° |
N1 | C1 | O4 | H8 | 0.0° | 90.0° |
C2 | C1 | N1 | O1 | 0.2° | 90.0° |
C1 | C2 | C6 | O1 | 0.4° | 90.0° |
C1 | C2 | C6 | C3 | 179.4° | 90.0° |
C1 | C2 | C3 | C4 | 158.7° | 90.0° |
C1 | C2 | C3 | H3 | 38.7° | 90.0° |
C1 | C2 | C3 | H3A | 81.3° | 90.0° |
C1 | C2 | C6 | C5 | 178.3° | 90.0° |
C2 | C1 | O4 | H8 | 179.7° | 90.0° |
N1 | O1 | C6 | C2 | 0.5° | 90.0° |
O1 | N1 | C1 | O4 | 179.9° | 90.0° |
N1 | O1 | C6 | C5 | 178.1° | 90.0° |
O1 | C6 | C2 | C5 | 177.9° | 90.0° |
O1 | C6 | C5 | N2 | 170.1° | 90.0° |
O1 | C6 | C2 | C3 | 179.8° | 90.0° |
O1 | C6 | C5 | C7 | 65.4° | 90.0° |
O1 | C6 | C5 | H5 | 52.4° | 90.0° |
C2 | C6 | C5 | N2 | 7.3° | 90.0° |
C6 | C2 | C3 | C4 | 20.6° | 90.0° |
C6 | C2 | C3 | H3 | 140.6° | 90.0° |
C6 | C2 | C3 | H3A | 99.4° | 90.0° |
C6 | C2 | C1 | O4 | 179.6° | 90.0° |
C2 | C6 | C5 | C7 | 117.3° | 90.0° |
C2 | C6 | C5 | H5 | 124.9° | 90.0° |
C5 | N2 | HN2 | C4 | 123.1° | 90.0° |
C5 | N2 | C4 | C3 | 67.5° | 90.0° |
C5 | N2 | C4 | H4 | 52.5° | 90.0° |
C5 | N2 | C4 | H4A | 172.5° | 90.0° |
N2 | C5 | C7 | H5 | 118.0° | 90.0° |
N2 | C5 | C7 | C6 | 126.2° | 90.0° |
N2 | C5 | H5 | C6 | 120.6° | 90.0° |
N2 | C5 | C7 | O2 | 143.9° | 90.0° |
N2 | C5 | C7 | O3 | 38.9° | 90.0° |
HN2 | N2 | C4 | C3 | 52.5° | 90.0° |
HN2 | N2 | C4 | H4 | 172.5° | 90.0° |
HN2 | N2 | C4 | H4A | 67.5° | 90.0° |
HN2 | N2 | C5 | C7 | 155.6° | 90.0° |
HN2 | N2 | C5 | H5 | 37.6° | 90.0° |
HN2 | N2 | C5 | C6 | 78.3° | 90.0° |
C2 | C3 | C4 | H3 | 120.0° | 90.0° |
C2 | C3 | C4 | H3A | 120.0° | 90.0° |
C2 | C3 | H3 | H3A | 120.8° | 90.0° |
C2 | C3 | C4 | N2 | 53.2° | 90.0° |
C2 | C3 | C4 | H4 | 66.9° | 90.0° |
C2 | C3 | C4 | H4A | 173.1° | 90.0° |
C3 | C2 | C1 | O4 | 0.2° | 90.0° |
C3 | C2 | C6 | C5 | 2.2° | 90.0° |
C4 | C3 | H3 | H3A | 120.7° | 90.0° |
C3 | C4 | N2 | H4 | 120.0° | 90.0° |
C3 | C4 | N2 | H4A | 120.0° | 90.0° |
C3 | C4 | H4 | H4A | 119.8° | 90.0° |
H3 | C3 | C4 | N2 | 173.2° | 90.0° |
H3 | C3 | C4 | H4 | 53.2° | 90.0° |
H3 | C3 | C4 | H4A | 66.9° | 90.0° |
H3A | C3 | C4 | N2 | 66.9° | 90.0° |
H3A | C3 | C4 | H4 | 173.1° | 90.0° |
H3A | C3 | C4 | H4A | 53.1° | 90.0° |
HO3 | O3 | C7 | C5 | 176.9° | 90.0° |
HO3 | O3 | C7 | O2 | 0.0° | 90.0° |
N2 | C4 | H4 | H4A | 119.8° | 90.0° |
C4 | N2 | C5 | C7 | 84.3° | 90.0° |
C4 | N2 | C5 | H5 | 157.6° | 90.0° |
C4 | N2 | C5 | C6 | 41.8° | 90.0° |
C7 | C5 | H5 | C6 | 120.5° | 90.0° |
C5 | C7 | O2 | O3 | 176.8° | 90.0° |
H5 | C5 | C7 | O2 | 98.1° | 90.0° |
H5 | C5 | C7 | O3 | 79.0° | 90.0° |
C6 | C5 | C7 | O2 | 17.7° | 90.0° |
C6 | C5 | C7 | O3 | 165.1° | 90.0° |