MN0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.51Å | 1.55Å | |
C2 | O2 | sing | 1.43Å | 1.46Å | |
O2 | C12 | sing | 1.43Å | 1.47Å | |
C3 | C2 | sing | 1.53Å | 1.55Å | |
C3 | H32 | sing | 1.09Å | 1.10Å | |
C3 | H31 | sing | 1.09Å | 1.10Å | |
C4 | C3 | sing | 1.53Å | 1.54Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
O4 | C4 | sing | 1.43Å | 1.43Å | |
O4 | HO4 | sing | 0.97Å | 0.95Å | |
C5 | C4 | sing | 1.53Å | 1.52Å | |
C5 | C6 | sing | 1.53Å | 1.54Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
N5 | C5 | sing | 1.47Å | 1.48Å | |
N5 | HN5 | sing | 0.97Å | 1.00Å | |
C6 | C7 | sing | 1.53Å | 1.53Å | |
C6 | O6 | sing | 1.43Å | 1.47Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
O6 | C2 | sing | 1.43Å | 1.46Å | |
C7 | O7 | sing | 1.43Å | 1.43Å | |
C7 | C8 | sing | 1.53Å | 1.54Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
O7 | HO7 | sing | 0.97Å | 0.95Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
O8 | C8 | sing | 1.43Å | 1.43Å | |
O8 | HO8 | sing | 0.97Å | 0.95Å | |
C9 | C8 | sing | 1.53Å | 1.52Å | |
C9 | O9 | sing | 1.43Å | 1.43Å | |
C9 | H92 | sing | 1.09Å | 1.10Å | |
C9 | H91 | sing | 1.09Å | 1.10Å | |
O9 | HO9 | sing | 0.97Å | 0.95Å | |
C10 | N5 | sing | 1.35Å | 1.34Å | |
C10 | O10 | doub | 1.21Å | 1.23Å | |
C11 | C10 | sing | 1.51Å | 1.53Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
O11 | C11 | sing | 1.43Å | 1.36Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C12 | H12A | sing | 1.09Å | 1.10Å | |
C12 | H12B | sing | 1.09Å | 1.10Å | |
O1B | C1 | sing | 1.34Å | 1.25Å | |
O1A | C1 | doub | 1.21Å | 1.25Å | |
C11 | H113 | sing | 1.09Å | 1.10Å | |
O11 | H20 | sing | 0.97Å | 0.95Å | |
O1B | HO1B | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C1 | C2 | O2 | 108.7° | 109.5° |
C1 | C2 | C3 | 109.3° | 109.5° |
C1 | C2 | O6 | 112.3° | 109.5° |
C2 | C1 | O1B | 117.5° | 120.0° |
C2 | C1 | O1A | 117.9° | 120.0° |
C2 | O2 | C12 | 117.5° | 114.0° |
O2 | C2 | C3 | 108.0° | 109.5° |
O2 | C2 | O6 | 109.5° | 109.5° |
O2 | C12 | H12 | 109.5° | 109.5° |
O2 | C12 | H12A | 109.5° | 109.5° |
O2 | C12 | H12B | 109.5° | 109.5° |
C2 | C3 | H32 | 108.5° | 109.5° |
C2 | C3 | H31 | 108.5° | 109.6° |
C2 | C3 | C4 | 112.4° | 109.1° |
C3 | C2 | O6 | 108.9° | 109.5° |
H32 | C3 | H31 | 110.4° | 109.5° |
H32 | C3 | C4 | 108.5° | 109.5° |
H31 | C3 | C4 | 108.5° | 109.6° |
C3 | C4 | H4 | 106.9° | 109.5° |
C3 | C4 | O4 | 110.5° | 109.5° |
C3 | C4 | C5 | 111.9° | 109.0° |
H4 | C4 | O4 | 110.0° | 109.5° |
H4 | C4 | C5 | 108.5° | 109.6° |
C4 | O4 | HO4 | 109.5° | 114.0° |
O4 | C4 | C5 | 109.0° | 109.7° |
C4 | C5 | C6 | 109.8° | 109.2° |
C4 | C5 | H5 | 112.0° | 109.6° |
C4 | C5 | N5 | 107.8° | 109.5° |
C6 | C5 | H5 | 105.6° | 109.5° |
C6 | C5 | N5 | 113.9° | 109.5° |
C5 | C6 | C7 | 119.8° | 109.5° |
C5 | C6 | O6 | 108.6° | 109.4° |
C5 | C6 | H6 | 101.2° | 109.4° |
H5 | C5 | N5 | 107.7° | 109.6° |
C5 | N5 | HN5 | 118.5° | 120.0° |
C5 | N5 | C10 | 122.9° | 120.0° |
HN5 | N5 | C10 | 118.6° | 120.0° |
C7 | C6 | O6 | 103.3° | 109.5° |
C7 | C6 | H6 | 106.6° | 109.5° |
C6 | C7 | O7 | 110.3° | 109.5° |
C6 | C7 | C8 | 110.6° | 109.5° |
C6 | C7 | H7 | 108.1° | 109.5° |
O6 | C6 | H6 | 118.3° | 109.5° |
C6 | O6 | C2 | 116.8° | 114.1° |
O7 | C7 | C8 | 109.5° | 109.5° |
O7 | C7 | H7 | 109.4° | 109.5° |
C7 | O7 | HO7 | 109.5° | 114.0° |
C8 | C7 | H7 | 108.9° | 109.5° |
C7 | C8 | H8 | 108.1° | 109.5° |
C7 | C8 | O8 | 109.4° | 109.5° |
C7 | C8 | C9 | 111.3° | 109.5° |
H8 | C8 | O8 | 110.4° | 109.4° |
H8 | C8 | C9 | 108.5° | 109.5° |
C8 | O8 | HO8 | 109.5° | 114.0° |
O8 | C8 | C9 | 109.1° | 109.5° |
C8 | C9 | O9 | 108.8° | 109.5° |
C8 | C9 | H92 | 109.7° | 109.5° |
C8 | C9 | H91 | 109.7° | 109.5° |
O9 | C9 | H92 | 109.7° | 109.4° |
O9 | C9 | H91 | 109.7° | 109.5° |
C9 | O9 | HO9 | 109.5° | 114.0° |
H92 | C9 | H91 | 109.2° | 109.5° |
N5 | C10 | O10 | 123.7° | 120.1° |
N5 | C10 | C11 | 118.3° | 120.0° |
O10 | C10 | C11 | 118.0° | 120.0° |
C10 | C11 | H111 | 106.7° | 109.4° |
C10 | C11 | O11 | 118.1° | 109.5° |
C10 | C11 | H113 | 106.7° | 109.5° |
H111 | C11 | O11 | 106.7° | 109.5° |
H111 | C11 | H113 | 112.1° | 109.5° |
O11 | C11 | H113 | 106.7° | 109.5° |
C11 | O11 | H20 | 109.5° | 114.0° |
H12 | C12 | H12A | 109.4° | 109.5° |
H12 | C12 | H12B | 109.4° | 109.4° |
H12A | C12 | H12B | 109.5° | 109.5° |
O1B | C1 | O1A | 124.6° | 120.0° |
C1 | O1B | HO1B | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | C2 | O2 | C3 | 118.5° | 120.0° |
C1 | C2 | O2 | O6 | 123.0° | 120.0° |
C1 | C2 | O2 | C12 | 104.0° | 175.1° |
C1 | C2 | C3 | O6 | 123.0° | 120.0° |
C1 | C2 | C3 | H32 | 166.5° | 177.7° |
C1 | C2 | C3 | H31 | 46.5° | 57.6° |
C1 | C2 | C3 | C4 | 73.5° | 62.4° |
C1 | C2 | O6 | C6 | 65.0° | 58.8° |
C2 | C1 | O1B | O1A | 179.3° | 179.7° |
C2 | C1 | O1B | HO1B | 179.3° | 180.0° |
O2 | C2 | C3 | O6 | 118.8° | 120.0° |
O2 | C2 | C3 | H32 | 48.4° | 57.7° |
O2 | C2 | C3 | H31 | 71.6° | 62.4° |
O2 | C2 | C3 | C4 | 168.4° | 177.6° |
O2 | C2 | O6 | C6 | 174.2° | 178.8° |
C2 | O2 | C12 | H12 | 180.0° | 174.3° |
C2 | O2 | C12 | H12A | 60.0° | 65.7° |
C2 | O2 | C12 | H12B | 60.0° | 54.4° |
O2 | C2 | C1 | O1B | 70.8° | 175.7° |
O2 | C2 | C1 | O1A | 108.5° | 4.0° |
C12 | O2 | C2 | C3 | 137.4° | 64.9° |
C12 | O2 | C2 | O6 | 19.0° | 55.1° |
O2 | C12 | H12 | H12A | 120.0° | 120.0° |
O2 | C12 | H12 | H12B | 120.0° | 120.0° |
O2 | C12 | H12A | H12B | 120.0° | 120.1° |
C2 | C3 | H32 | H31 | 118.8° | 120.2° |
C2 | C3 | H32 | C4 | 122.4° | 119.6° |
C2 | C3 | H31 | C4 | 122.4° | 119.7° |
C2 | C3 | C4 | H4 | 67.2° | 63.0° |
C2 | C3 | C4 | O4 | 173.1° | 176.9° |
C2 | C3 | C4 | C5 | 51.5° | 57.0° |
C3 | C2 | O6 | C6 | 56.3° | 61.2° |
C3 | C2 | C1 | O1B | 46.9° | 55.7° |
C3 | C2 | C1 | O1A | 133.8° | 124.0° |
H32 | C3 | H31 | C4 | 118.8° | 120.2° |
H32 | C3 | C4 | H4 | 172.8° | 177.2° |
H32 | C3 | C4 | O4 | 53.1° | 57.1° |
H32 | C3 | C4 | C5 | 68.5° | 62.9° |
H32 | C3 | C2 | O6 | 70.4° | 62.2° |
H31 | C3 | C4 | H4 | 52.9° | 57.0° |
H31 | C3 | C4 | O4 | 66.9° | 63.1° |
H31 | C3 | C4 | C5 | 171.5° | 177.0° |
H31 | C3 | C2 | O6 | 169.6° | 177.6° |
C3 | C4 | H4 | O4 | 120.0° | 120.1° |
C3 | C4 | H4 | C5 | 120.9° | 119.6° |
C3 | C4 | O4 | C5 | 123.3° | 119.6° |
C3 | C4 | O4 | HO4 | 180.0° | 59.9° |
C3 | C4 | C5 | C6 | 54.6° | 57.0° |
C3 | C4 | C5 | H5 | 62.4° | 63.0° |
C3 | C4 | C5 | N5 | 179.3° | 176.9° |
C4 | C3 | C2 | O6 | 49.6° | 57.6° |
H4 | C4 | O4 | C5 | 118.9° | 120.3° |
H4 | C4 | O4 | HO4 | 62.2° | 60.2° |
H4 | C4 | C5 | C6 | 63.1° | 62.9° |
H4 | C4 | C5 | H5 | 179.8° | 177.2° |
H4 | C4 | C5 | N5 | 61.5° | 57.0° |
O4 | C4 | C5 | C6 | 177.1° | 176.9° |
O4 | C4 | C5 | H5 | 60.0° | 56.9° |
O4 | C4 | C5 | N5 | 58.2° | 63.2° |
HO4 | O4 | C4 | C5 | 56.7° | 179.5° |
C4 | C5 | C6 | H5 | 121.0° | 120.0° |
C4 | C5 | C6 | N5 | 121.0° | 119.9° |
C4 | C5 | H5 | N5 | 118.4° | 120.1° |
C4 | C5 | N5 | HN5 | 34.7° | 95.0° |
C4 | C5 | C6 | C7 | 174.9° | 177.6° |
C4 | C5 | C6 | O6 | 56.7° | 57.6° |
C4 | C5 | C6 | H6 | 68.4° | 62.4° |
C4 | C5 | N5 | C10 | 145.3° | 85.0° |
C6 | C5 | H5 | N5 | 122.1° | 120.1° |
C6 | C5 | N5 | HN5 | 87.4° | 24.7° |
C5 | C6 | C7 | O6 | 120.9° | 119.9° |
C5 | C6 | C7 | H6 | 113.8° | 120.0° |
C5 | C6 | O6 | H6 | 114.4° | 120.0° |
C5 | C6 | O6 | C2 | 60.6° | 61.2° |
C5 | C6 | C7 | O7 | 50.9° | 55.0° |
C5 | C6 | C7 | C8 | 172.1° | 175.0° |
C5 | C6 | C7 | H7 | 68.6° | 65.0° |
C6 | C5 | N5 | C10 | 92.5° | 155.3° |
H5 | C5 | N5 | HN5 | 155.7° | 144.8° |
H5 | C5 | C6 | C7 | 53.9° | 57.7° |
H5 | C5 | C6 | O6 | 64.3° | 62.4° |
H5 | C5 | C6 | H6 | 170.6° | 177.6° |
H5 | C5 | N5 | C10 | 24.3° | 35.2° |
C5 | N5 | HN5 | C10 | 180.0° | 180.0° |
N5 | C5 | C6 | C7 | 64.0° | 62.5° |
N5 | C5 | C6 | O6 | 177.7° | 177.5° |
N5 | C5 | C6 | H6 | 52.6° | 57.5° |
C5 | N5 | C10 | O10 | 3.5° | 0.0° |
C5 | N5 | C10 | C11 | 178.2° | 180.0° |
HN5 | N5 | C10 | O10 | 176.5° | 180.0° |
HN5 | N5 | C10 | C11 | 1.8° | 0.0° |
C7 | C6 | O6 | H6 | 117.4° | 120.0° |
C7 | C6 | O6 | C2 | 171.2° | 178.8° |
C6 | C7 | O7 | C8 | 121.9° | 120.0° |
C6 | C7 | O7 | H7 | 118.8° | 120.0° |
C6 | C7 | C8 | H7 | 118.8° | 120.0° |
C6 | C7 | O7 | HO7 | 72.3° | 60.0° |
C6 | C7 | C8 | H8 | 78.6° | 60.0° |
C6 | C7 | C8 | O8 | 41.7° | 60.0° |
C6 | C7 | C8 | C9 | 162.3° | 180.0° |
O6 | C6 | C7 | O7 | 70.0° | 64.9° |
O6 | C6 | C7 | C8 | 51.3° | 55.1° |
O6 | C6 | C7 | H7 | 170.5° | 175.1° |
H6 | C6 | O6 | C2 | 53.7° | 58.8° |
H6 | C6 | C7 | O7 | 164.7° | 175.0° |
H6 | C6 | C7 | C8 | 74.1° | 65.0° |
H6 | C6 | C7 | H7 | 45.2° | 55.0° |
O6 | C2 | C1 | O1B | 167.9° | 64.3° |
O6 | C2 | C1 | O1A | 12.8° | 116.0° |
O7 | C7 | C8 | H7 | 119.5° | 120.0° |
O7 | C7 | C8 | H8 | 43.1° | 60.0° |
O7 | C7 | C8 | O8 | 163.4° | 180.0° |
O7 | C7 | C8 | C9 | 76.0° | 60.0° |
C8 | C7 | O7 | HO7 | 165.8° | 60.0° |
C7 | C8 | H8 | O8 | 119.7° | 120.0° |
C7 | C8 | H8 | C9 | 120.9° | 120.0° |
C7 | C8 | O8 | C9 | 122.0° | 120.0° |
C7 | C8 | O8 | HO8 | 57.1° | 60.0° |
C7 | C8 | C9 | O9 | 170.8° | 175.0° |
C7 | C8 | C9 | H92 | 50.8° | 55.0° |
C7 | C8 | C9 | H91 | 69.2° | 65.0° |
H7 | C7 | O7 | HO7 | 46.5° | 180.0° |
H7 | C7 | C8 | H8 | 162.6° | NaN° |
H7 | C7 | C8 | O8 | 77.1° | 60.0° |
H7 | C7 | C8 | C9 | 43.6° | 60.0° |
H8 | C8 | O8 | C9 | 119.1° | 120.0° |
H8 | C8 | O8 | HO8 | 61.8° | 180.0° |
H8 | C8 | C9 | O9 | 51.9° | 55.0° |
H8 | C8 | C9 | H92 | 68.1° | 65.0° |
H8 | C8 | C9 | H91 | 172.0° | 175.0° |
O8 | C8 | C9 | O9 | 68.4° | 65.0° |
O8 | C8 | C9 | H92 | 171.6° | 175.1° |
O8 | C8 | C9 | H91 | 51.6° | 55.0° |
HO8 | O8 | C8 | C9 | 179.1° | 60.0° |
C8 | C9 | O9 | H92 | 120.0° | 120.0° |
C8 | C9 | O9 | H91 | 120.0° | 120.0° |
C8 | C9 | H92 | H91 | 120.3° | 120.0° |
C8 | C9 | O9 | HO9 | 180.0° | 180.0° |
O9 | C9 | H92 | H91 | 120.3° | 120.0° |
H92 | C9 | O9 | HO9 | 60.0° | 60.0° |
H91 | C9 | O9 | HO9 | 60.0° | 60.0° |
N5 | C10 | O10 | C11 | 178.4° | 179.9° |
N5 | C10 | C11 | H111 | 117.1° | 60.1° |
N5 | C10 | C11 | O11 | 2.9° | 180.0° |
N5 | C10 | C11 | H113 | 122.9° | 60.0° |
O10 | C10 | C11 | H111 | 61.3° | 120.0° |
O10 | C10 | C11 | O11 | 178.6° | 0.0° |
O10 | C10 | C11 | H113 | 58.6° | 119.9° |
C10 | C11 | H111 | O11 | 127.1° | 120.0° |
C10 | C11 | H111 | H113 | 116.4° | 120.0° |
C10 | C11 | O11 | H113 | 120.0° | 120.0° |
C10 | C11 | O11 | H20 | 180.0° | 180.0° |
H111 | C11 | O11 | H113 | 120.0° | 120.1° |
H111 | C11 | O11 | H20 | 60.0° | 60.0° |
H12 | C12 | H12A | H12B | 120.0° | 119.9° |
O1A | C1 | O1B | HO1B | 0.0° | 0.3° |
H113 | C11 | O11 | H20 | 60.0° | 60.0° |