C5J
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N6 | C5 | sing | 1.35Å | 1.36Å | |
N1 | C2 | sing | 1.35Å | 1.34Å | |
O7 | C5 | doub | 1.22Å | 1.21Å | |
C5 | N4 | sing | 1.35Å | 1.37Å | |
C2 | N4 | sing | 1.35Å | 1.36Å | |
C2 | O3 | doub | 1.22Å | 1.21Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
N1 | H2 | sing | 0.97Å | 1.00Å | |
N6 | H3 | sing | 0.97Å | 1.00Å | |
N6 | H4 | sing | 0.97Å | 1.00Å | |
N4 | H5 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N6 | C5 | O7 | 119.6° | 120.0° |
N6 | C5 | N4 | 115.4° | 120.0° |
C5 | N6 | H3 | 120.0° | 120.0° |
C5 | N6 | H4 | 120.0° | 120.0° |
N1 | C2 | N4 | 116.8° | 120.0° |
N1 | C2 | O3 | 119.5° | 120.0° |
C2 | N1 | H1 | 120.0° | 120.0° |
C2 | N1 | H2 | 120.0° | 120.0° |
O7 | C5 | N4 | 124.8° | 120.0° |
C5 | N4 | C2 | 124.2° | 120.0° |
C5 | N4 | H5 | 117.9° | 120.0° |
N4 | C2 | O3 | 123.7° | 120.0° |
C2 | N4 | H5 | 117.9° | 120.0° |
H1 | N1 | H2 | 120.0° | 120.0° |
H3 | N6 | H4 | 120.0° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N6 | C5 | O7 | N4 | 175.1° | 180.0° |
N6 | C5 | N4 | C2 | 139.7° | NaN° |
C5 | N6 | H3 | H4 | 180.0° | 179.9° |
N6 | C5 | N4 | H5 | 40.3° | 0.0° |
N1 | C2 | N4 | C5 | 15.5° | 179.7° |
N1 | C2 | N4 | O3 | 179.0° | 179.7° |
C2 | N1 | H1 | H2 | 180.0° | 180.0° |
N1 | C2 | N4 | H5 | 164.5° | 0.3° |
O7 | C5 | N4 | C2 | 44.9° | 0.0° |
O7 | C5 | N6 | H3 | 0.0° | 180.0° |
O7 | C5 | N6 | H4 | 180.0° | 0.1° |
O7 | C5 | N4 | H5 | 135.0° | 180.0° |
C5 | N4 | C2 | H5 | 180.0° | 180.0° |
C5 | N4 | C2 | O3 | 165.5° | 0.0° |
N4 | C5 | N6 | H3 | 175.6° | 0.0° |
N4 | C5 | N6 | H4 | 4.4° | 180.0° |
N4 | C2 | N1 | H1 | 179.1° | 0.0° |
N4 | C2 | N1 | H2 | 0.9° | 180.0° |
O3 | C2 | N1 | H1 | 0.0° | 179.7° |
O3 | C2 | N1 | H2 | 180.0° | 0.3° |
O3 | C2 | N4 | H5 | 14.5° | 180.0° |