OG2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | N2 | sing | 1.46Å | 1.47Å | |
| N2 | C | sing | 1.37Å | 1.34Å | |
| C | N1 | sing | 1.37Å | 1.34Å | |
| C | N | doub | 1.30Å | 1.29Å | |
| N1 | C1 | sing | 1.46Å | 1.48Å | |
| C1 | C9 | sing | 1.53Å | 1.54Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C8 | C10 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C3 | C10 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C7 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| N2 | H4 | sing | 0.97Å | 1.00Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| N | H18 | sing | 0.97Å | 1.00Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C11 | N2 | 114.0° | 109.5° |
| C12 | C11 | H19 | 108.4° | 109.5° |
| C12 | C11 | H20 | 108.3° | 109.5° |
| C11 | C12 | H21 | 109.5° | 109.5° |
| C11 | C12 | H22 | 109.5° | 109.5° |
| C11 | C12 | H23 | 109.5° | 109.5° |
| C11 | N2 | C | 124.8° | 120.0° |
| C11 | N2 | H4 | 117.6° | 120.0° |
| N2 | C11 | H19 | 108.3° | 109.4° |
| N2 | C11 | H20 | 108.3° | 109.5° |
| N2 | C | N1 | 118.4° | 120.0° |
| N2 | C | N | 121.4° | 120.0° |
| C | N2 | H4 | 117.6° | 120.0° |
| N1 | C | N | 119.9° | 120.0° |
| C | N1 | C1 | 131.3° | 120.1° |
| C | N1 | H1 | 114.3° | 119.9° |
| C | N | H18 | 112.0° | 120.0° |
| N1 | C1 | C9 | 108.5° | 109.5° |
| N1 | C1 | C2 | 113.1° | 109.4° |
| N1 | C1 | C6 | 108.4° | 109.5° |
| C1 | N1 | H1 | 114.4° | 120.0° |
| C9 | C1 | C2 | 108.9° | 109.4° |
| C9 | C1 | C6 | 108.9° | 109.5° |
| C1 | C9 | C8 | 110.0° | 109.5° |
| C1 | C9 | H14 | 109.4° | 109.4° |
| C1 | C9 | H15 | 109.4° | 109.5° |
| C2 | C1 | C6 | 109.0° | 109.5° |
| C1 | C2 | C3 | 109.9° | 109.4° |
| C1 | C2 | H2 | 109.4° | 109.4° |
| C1 | C2 | H3 | 109.4° | 109.5° |
| C1 | C6 | C5 | 109.9° | 109.5° |
| C1 | C6 | H9 | 109.4° | 109.5° |
| C1 | C6 | H10 | 109.4° | 109.5° |
| C9 | C8 | C10 | 109.5° | 109.5° |
| C9 | C8 | C7 | 109.4° | 109.4° |
| C9 | C8 | H13 | 109.4° | 109.5° |
| C8 | C9 | H14 | 109.3° | 109.5° |
| C8 | C9 | H15 | 109.3° | 109.5° |
| C2 | C3 | C10 | 109.5° | 109.4° |
| C2 | C3 | C4 | 109.4° | 109.5° |
| C3 | C2 | H2 | 109.4° | 109.4° |
| C3 | C2 | H3 | 109.4° | 109.5° |
| C2 | C3 | H5 | 109.4° | 109.4° |
| C6 | C5 | C7 | 109.3° | 109.5° |
| C6 | C5 | C4 | 109.5° | 109.5° |
| C6 | C5 | H8 | 109.4° | 109.5° |
| C5 | C6 | H9 | 109.4° | 109.5° |
| C5 | C6 | H10 | 109.4° | 109.5° |
| C10 | C8 | C7 | 109.6° | 109.5° |
| C8 | C10 | C3 | 109.5° | 109.5° |
| C10 | C8 | H13 | 109.5° | 109.5° |
| C8 | C10 | H16 | 109.4° | 109.4° |
| C8 | C10 | H17 | 109.4° | 109.5° |
| C8 | C7 | C5 | 109.6° | 109.5° |
| C8 | C7 | H11 | 109.4° | 109.5° |
| C8 | C7 | H12 | 109.4° | 109.4° |
| C7 | C8 | H13 | 109.5° | 109.5° |
| C10 | C3 | C4 | 109.5° | 109.5° |
| C10 | C3 | H5 | 109.5° | 109.4° |
| C3 | C10 | H16 | 109.5° | 109.4° |
| C3 | C10 | H17 | 109.5° | 109.5° |
| C3 | C4 | C5 | 109.4° | 109.4° |
| C4 | C3 | H5 | 109.5° | 109.5° |
| C3 | C4 | H6 | 109.5° | 109.5° |
| C3 | C4 | H7 | 109.5° | 109.5° |
| C7 | C5 | C4 | 109.7° | 109.5° |
| C7 | C5 | H8 | 109.5° | 109.4° |
| C5 | C7 | H11 | 109.5° | 109.5° |
| C5 | C7 | H12 | 109.5° | 109.5° |
| C5 | C4 | H6 | 109.5° | 109.4° |
| C5 | C4 | H7 | 109.5° | 109.5° |
| C4 | C5 | H8 | 109.4° | 109.4° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.4° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.5° |
| H14 | C9 | H15 | 109.5° | 109.5° |
| H16 | C10 | H17 | 109.5° | 109.5° |
| H19 | C11 | H20 | 109.5° | 109.5° |
| H21 | C12 | H22 | 109.5° | 109.5° |
| H21 | C12 | H23 | 109.5° | 109.5° |
| H22 | C12 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C11 | N2 | H19 | 120.7° | 119.9° |
| C12 | C11 | N2 | H20 | 120.7° | 120.0° |
| C12 | C11 | N2 | C | 66.8° | 180.0° |
| C12 | C11 | N2 | H4 | 113.2° | 0.1° |
| C12 | C11 | H19 | H20 | 118.0° | 120.0° |
| C11 | C12 | H21 | H22 | 120.0° | 120.0° |
| C11 | C12 | H21 | H23 | 120.0° | 120.0° |
| C11 | C12 | H22 | H23 | 120.0° | 120.0° |
| C11 | N2 | C | H4 | 180.0° | 179.9° |
| C11 | N2 | C | N1 | 175.8° | 180.0° |
| C11 | N2 | C | N | 10.1° | 0.1° |
| N2 | C11 | H19 | H20 | 117.9° | 120.1° |
| N2 | C11 | C12 | H21 | 180.0° | 60.1° |
| N2 | C11 | C12 | H22 | 60.0° | 60.0° |
| N2 | C11 | C12 | H23 | 60.0° | 180.0° |
| N2 | C | N1 | N | 174.2° | 179.9° |
| N2 | C | N1 | C1 | 176.4° | 175.1° |
| N2 | C | N1 | H1 | 3.6° | 4.8° |
| N2 | C | N | H18 | 174.1° | 175.2° |
| C | N2 | C11 | H19 | 172.5° | 60.1° |
| C | N2 | C11 | H20 | 53.8° | 59.9° |
| C | N1 | C1 | H1 | 180.0° | 180.0° |
| C | N1 | C1 | C9 | 173.2° | 54.6° |
| C | N1 | C1 | C2 | 65.8° | 65.4° |
| C | N1 | C1 | C6 | 55.2° | 174.6° |
| N1 | C | N2 | H4 | 4.2° | 0.1° |
| N1 | C | N | H18 | 0.0° | 4.9° |
| N | C | N1 | C1 | 9.4° | 4.8° |
| N | C | N1 | H1 | 170.6° | 175.2° |
| N | C | N2 | H4 | 170.0° | 179.9° |
| N1 | C1 | C9 | C2 | 123.5° | 119.9° |
| N1 | C1 | C9 | C6 | 117.7° | 120.1° |
| N1 | C1 | C2 | C6 | 120.6° | 120.0° |
| N1 | C1 | C9 | C8 | 176.9° | 179.9° |
| N1 | C1 | C2 | C3 | 179.9° | 180.0° |
| N1 | C1 | C6 | C5 | 177.2° | 180.0° |
| N1 | C1 | C2 | H2 | 59.9° | 60.1° |
| N1 | C1 | C2 | H3 | 60.0° | 60.0° |
| N1 | C1 | C6 | H9 | 57.1° | 60.0° |
| N1 | C1 | C6 | H10 | 62.7° | 60.0° |
| N1 | C1 | C9 | H14 | 63.0° | 60.0° |
| N1 | C1 | C9 | H15 | 56.9° | 60.1° |
| C9 | C1 | C2 | C6 | 118.7° | 120.0° |
| C1 | C9 | C8 | H14 | 120.1° | 120.0° |
| C1 | C9 | C8 | H15 | 120.1° | 120.0° |
| C9 | C1 | C2 | C3 | 59.3° | 60.0° |
| C9 | C1 | C6 | C5 | 59.4° | 60.0° |
| C1 | C9 | C8 | C10 | 60.1° | 60.0° |
| C1 | C9 | C8 | C7 | 60.0° | 60.0° |
| C9 | C1 | N1 | H1 | 6.8° | 125.4° |
| C9 | C1 | C2 | H2 | 179.4° | 180.0° |
| C9 | C1 | C2 | H3 | 60.7° | 60.0° |
| C9 | C1 | C6 | H9 | 60.7° | 60.0° |
| C9 | C1 | C6 | H10 | 179.5° | 180.0° |
| C1 | C9 | C8 | H13 | 179.9° | 180.0° |
| C1 | C9 | H14 | H15 | 119.8° | 120.0° |
| C2 | C1 | C9 | C8 | 59.5° | 60.0° |
| C1 | C2 | C3 | H2 | 120.1° | 119.9° |
| C1 | C2 | C3 | H3 | 120.1° | 120.0° |
| C2 | C1 | C6 | C5 | 59.3° | 60.0° |
| C1 | C2 | C3 | C10 | 59.9° | 60.1° |
| C1 | C2 | C3 | C4 | 60.1° | 60.0° |
| C2 | C1 | N1 | H1 | 114.2° | 114.6° |
| C1 | C2 | H2 | H3 | 119.8° | 120.0° |
| C1 | C2 | C3 | H5 | 179.9° | 180.0° |
| C2 | C1 | C6 | H9 | 179.4° | 180.0° |
| C2 | C1 | C6 | H10 | 60.7° | 60.0° |
| C2 | C1 | C9 | H14 | 60.6° | 60.0° |
| C2 | C1 | C9 | H15 | 179.6° | 180.0° |
| C6 | C1 | C9 | C8 | 59.2° | 60.0° |
| C6 | C1 | C2 | C3 | 59.3° | 60.0° |
| C1 | C6 | C5 | H9 | 120.1° | 120.0° |
| C1 | C6 | C5 | H10 | 120.1° | 120.0° |
| C1 | C6 | C5 | C7 | 60.2° | 60.0° |
| C1 | C6 | C5 | C4 | 60.0° | 60.0° |
| C6 | C1 | N1 | H1 | 124.8° | 5.4° |
| C6 | C1 | C2 | H2 | 60.7° | 59.9° |
| C6 | C1 | C2 | H3 | 179.4° | 180.0° |
| C1 | C6 | C5 | H8 | 179.9° | 180.0° |
| C1 | C6 | H9 | H10 | 119.8° | 120.0° |
| C6 | C1 | C9 | H14 | 179.3° | 180.0° |
| C6 | C1 | C9 | H15 | 60.8° | 60.0° |
| C9 | C8 | C10 | C7 | 120.0° | 119.9° |
| C9 | C8 | C10 | H13 | 119.9° | 120.0° |
| C9 | C8 | C7 | H13 | 119.8° | 120.0° |
| C9 | C8 | C10 | C3 | 60.0° | 60.0° |
| C9 | C8 | C7 | C5 | 60.3° | 60.0° |
| C9 | C8 | C7 | H11 | 179.7° | 60.0° |
| C9 | C8 | C7 | H12 | 59.7° | 180.0° |
| C8 | C9 | H14 | H15 | 119.7° | 120.0° |
| C9 | C8 | C10 | H16 | 60.0° | 180.0° |
| C9 | C8 | C10 | H17 | 180.0° | 60.0° |
| C2 | C3 | C10 | C8 | 59.9° | 60.1° |
| C2 | C3 | C10 | C4 | 119.9° | 120.0° |
| C2 | C3 | C10 | H5 | 119.9° | 119.9° |
| C2 | C3 | C4 | H5 | 119.9° | 120.0° |
| C2 | C3 | C4 | C5 | 60.3° | 60.0° |
| C3 | C2 | H2 | H3 | 119.8° | 120.0° |
| C2 | C3 | C4 | H6 | 59.7° | 60.0° |
| C2 | C3 | C4 | H7 | 179.7° | 180.0° |
| C2 | C3 | C10 | H16 | 60.0° | 180.0° |
| C2 | C3 | C10 | H17 | 179.9° | 60.0° |
| C6 | C5 | C7 | C8 | 60.4° | 60.0° |
| C6 | C5 | C4 | C3 | 60.3° | 60.0° |
| C6 | C5 | C7 | C4 | 120.1° | 120.1° |
| C6 | C5 | C7 | H8 | 119.8° | 120.0° |
| C6 | C5 | C4 | H8 | 119.8° | 120.0° |
| C6 | C5 | C4 | H6 | 59.7° | 59.9° |
| C6 | C5 | C4 | H7 | 179.7° | 180.0° |
| C5 | C6 | H9 | H10 | 119.8° | 120.0° |
| C6 | C5 | C7 | H11 | 179.6° | 60.0° |
| C6 | C5 | C7 | H12 | 59.6° | 180.0° |
| C10 | C8 | C7 | H13 | 120.1° | 120.0° |
| C8 | C10 | C3 | H16 | 120.0° | 119.9° |
| C8 | C10 | C3 | H17 | 120.0° | 120.0° |
| C8 | C10 | C3 | C4 | 60.0° | 60.0° |
| C10 | C8 | C7 | C5 | 59.8° | 60.0° |
| C8 | C10 | C3 | H5 | 179.9° | 180.0° |
| C10 | C8 | C7 | H11 | 60.3° | 180.0° |
| C10 | C8 | C7 | H12 | 179.8° | 60.0° |
| C10 | C8 | C9 | H14 | 60.0° | 60.0° |
| C10 | C8 | C9 | H15 | 179.8° | 180.0° |
| C8 | C10 | H16 | H17 | 120.0° | 120.0° |
| C7 | C8 | C10 | C3 | 60.0° | 59.9° |
| C8 | C7 | C5 | H11 | 120.0° | 120.0° |
| C8 | C7 | C5 | H12 | 120.0° | 119.9° |
| C8 | C7 | C5 | C4 | 59.7° | 60.0° |
| C8 | C7 | C5 | H8 | 179.8° | 179.9° |
| C8 | C7 | H11 | H12 | 119.9° | 119.9° |
| C7 | C8 | C9 | H14 | 179.9° | 179.9° |
| C7 | C8 | C9 | H15 | 60.1° | 60.0° |
| C7 | C8 | C10 | H16 | 180.0° | 60.0° |
| C7 | C8 | C10 | H17 | 60.1° | 180.0° |
| C10 | C3 | C4 | H5 | 120.1° | 120.0° |
| C10 | C3 | C4 | C5 | 59.8° | 60.0° |
| C10 | C3 | C2 | H2 | 180.0° | 180.0° |
| C10 | C3 | C2 | H3 | 60.2° | 60.0° |
| C10 | C3 | C4 | H6 | 179.8° | 179.9° |
| C10 | C3 | C4 | H7 | 60.2° | 60.0° |
| C3 | C10 | C8 | H13 | 179.9° | 179.9° |
| C3 | C10 | H16 | H17 | 120.0° | 120.0° |
| C3 | C4 | C5 | C7 | 59.7° | 60.0° |
| C3 | C4 | C5 | H6 | 120.0° | 120.0° |
| C3 | C4 | C5 | H7 | 120.0° | 120.0° |
| C4 | C3 | C2 | H2 | 60.0° | 59.9° |
| C4 | C3 | C2 | H3 | 179.8° | 180.0° |
| C3 | C4 | H6 | H7 | 120.0° | 120.0° |
| C3 | C4 | C5 | H8 | 179.9° | 180.0° |
| C4 | C3 | C10 | H16 | 180.0° | 60.0° |
| C4 | C3 | C10 | H17 | 60.0° | 180.0° |
| C7 | C5 | C4 | H8 | 120.2° | 119.9° |
| C7 | C5 | C4 | H6 | 179.7° | 180.0° |
| C7 | C5 | C4 | H7 | 60.3° | 60.0° |
| C7 | C5 | C6 | H9 | 59.9° | 60.0° |
| C7 | C5 | C6 | H10 | 179.7° | 180.0° |
| C5 | C7 | H11 | H12 | 120.0° | 120.1° |
| C5 | C7 | C8 | H13 | 179.9° | 180.0° |
| C5 | C4 | C3 | H5 | 179.9° | 180.0° |
| C5 | C4 | H6 | H7 | 120.0° | 120.0° |
| C4 | C5 | C6 | H9 | 179.9° | 180.0° |
| C4 | C5 | C6 | H10 | 60.1° | 60.0° |
| C4 | C5 | C7 | H11 | 60.3° | 180.0° |
| C4 | C5 | C7 | H12 | 179.7° | 59.9° |
| H2 | C2 | C3 | H5 | 60.0° | 60.1° |
| H3 | C2 | C3 | H5 | 59.9° | 60.0° |
| H4 | N2 | C11 | H19 | 7.5° | 120.0° |
| H4 | N2 | C11 | H20 | 126.2° | 119.9° |
| H5 | C3 | C4 | H6 | 60.1° | 60.1° |
| H5 | C3 | C4 | H7 | 59.9° | 60.0° |
| H5 | C3 | C10 | H16 | 59.9° | 60.1° |
| H5 | C3 | C10 | H17 | 60.1° | 60.0° |
| H6 | C4 | C5 | H8 | 60.2° | 60.1° |
| H7 | C4 | C5 | H8 | 59.9° | 60.0° |
| H8 | C5 | C6 | H9 | 60.0° | 60.0° |
| H8 | C5 | C6 | H10 | 59.8° | 60.0° |
| H8 | C5 | C7 | H11 | 59.8° | 60.0° |
| H8 | C5 | C7 | H12 | 60.2° | 60.0° |
| H11 | C7 | C8 | H13 | 59.9° | 60.0° |
| H12 | C7 | C8 | H13 | 60.1° | 59.9° |
| H13 | C8 | C9 | H14 | 60.0° | 60.0° |
| H13 | C8 | C9 | H15 | 59.8° | 60.0° |
| H13 | C8 | C10 | H16 | 59.9° | 60.0° |
| H13 | C8 | C10 | H17 | 60.1° | 60.0° |
| H19 | C11 | C12 | H21 | 59.3° | 180.0° |
| H19 | C11 | C12 | H22 | 60.7° | 60.0° |
| H19 | C11 | C12 | H23 | 179.3° | 60.0° |
| H20 | C11 | C12 | H21 | 59.4° | 60.0° |
| H20 | C11 | C12 | H22 | 179.4° | 180.0° |
| H20 | C11 | C12 | H23 | 60.6° | 60.0° |
| H21 | C12 | H22 | H23 | 120.0° | 120.0° |
