V9C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | N1 | sing | 1.46Å | 1.47Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| N1 | C2 | sing | 1.35Å | 1.34Å | |
| C10 | CD1 | sing | 1.51Å | 1.51Å | |
| C2 | O3 | doub | 1.21Å | 1.23Å | |
| CD1 | CG | doub | 1.38Å | 1.40Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.40Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.40Å | Aromatic |
| CE1 | CZ | doub | 1.38Å | 1.40Å | Aromatic |
| CD2 | CE2 | doub | 1.38Å | 1.41Å | Aromatic |
| CZ | CE2 | sing | 1.38Å | 1.41Å | Aromatic |
| C2 | O1 | sing | 1.35Å | 1.54Å | |
| CG | H1 | sing | 1.08Å | 1.08Å | |
| CD2 | H2 | sing | 1.08Å | 1.08Å | |
| CE1 | H3 | sing | 1.08Å | 1.08Å | |
| CE2 | H4 | sing | 1.08Å | 1.08Å | |
| CZ | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| N1 | H10 | sing | 0.97Å | 1.00Å | |
| O1 | H11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C11 | C10 | 118.4° | 109.5° |
| C11 | N1 | C2 | 127.0° | 120.0° |
| N1 | C11 | H8 | 107.2° | 109.5° |
| N1 | C11 | H9 | 107.2° | 109.5° |
| C11 | N1 | H10 | 116.5° | 120.0° |
| C11 | C10 | CD1 | 110.3° | 109.5° |
| C11 | C10 | H6 | 109.3° | 109.4° |
| C11 | C10 | H7 | 109.3° | 109.5° |
| C10 | C11 | H8 | 107.2° | 109.4° |
| C10 | C11 | H9 | 107.2° | 109.5° |
| N1 | C2 | O3 | 113.0° | 120.0° |
| N1 | C2 | O1 | 127.6° | 120.0° |
| C2 | N1 | H10 | 116.5° | 120.0° |
| C10 | CD1 | CG | 120.2° | 119.9° |
| C10 | CD1 | CE1 | 119.7° | 120.0° |
| CD1 | C10 | H6 | 109.3° | 109.5° |
| CD1 | C10 | H7 | 109.3° | 109.5° |
| O3 | C2 | O1 | 118.8° | 120.0° |
| CG | CD1 | CE1 | 120.1° | 120.0° |
| CD1 | CG | CD2 | 119.8° | 120.0° |
| CD1 | CG | H1 | 120.1° | 120.0° |
| CD1 | CE1 | CZ | 120.4° | 120.0° |
| CD1 | CE1 | H3 | 119.8° | 120.0° |
| CG | CD2 | CE2 | 120.1° | 120.0° |
| CD2 | CG | H1 | 120.1° | 120.0° |
| CG | CD2 | H2 | 120.0° | 120.0° |
| CE1 | CZ | CE2 | 119.7° | 120.0° |
| CZ | CE1 | H3 | 119.8° | 120.0° |
| CE1 | CZ | H5 | 120.2° | 120.0° |
| CD2 | CE2 | CZ | 119.9° | 120.0° |
| CE2 | CD2 | H2 | 120.0° | 120.0° |
| CD2 | CE2 | H4 | 120.1° | 120.0° |
| CZ | CE2 | H4 | 120.1° | 120.0° |
| CE2 | CZ | H5 | 120.1° | 120.0° |
| C2 | O1 | H11 | 109.5° | 117.0° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H8 | C11 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C11 | C10 | H8 | 121.3° | 120.0° |
| N1 | C11 | C10 | H9 | 121.3° | 120.0° |
| C11 | N1 | C2 | H10 | 180.0° | 180.0° |
| N1 | C11 | C10 | CD1 | 52.0° | 180.0° |
| C11 | N1 | C2 | O3 | 7.0° | 0.0° |
| C11 | N1 | C2 | O1 | 164.7° | 180.0° |
| N1 | C11 | C10 | H6 | 172.1° | 60.0° |
| N1 | C11 | C10 | H7 | 68.2° | 60.0° |
| N1 | C11 | H8 | H9 | 115.9° | 120.1° |
| C10 | C11 | N1 | C2 | 105.2° | 180.0° |
| C11 | C10 | CD1 | H6 | 120.1° | 119.9° |
| C11 | C10 | CD1 | H7 | 120.1° | 120.0° |
| C11 | C10 | CD1 | CG | 70.0° | 90.0° |
| C11 | C10 | CD1 | CE1 | 108.2° | 90.0° |
| C11 | C10 | H6 | H7 | 119.7° | 120.0° |
| C10 | C11 | H8 | H9 | 116.0° | 120.0° |
| C10 | C11 | N1 | H10 | 74.8° | 0.0° |
| N1 | C2 | O3 | O1 | 172.5° | 180.0° |
| C2 | N1 | C11 | H8 | 16.1° | 60.0° |
| C2 | N1 | C11 | H9 | 133.5° | 60.0° |
| N1 | C2 | O1 | H11 | 171.2° | 180.0° |
| C10 | CD1 | CG | CE1 | 178.2° | 179.9° |
| C10 | CD1 | CG | CD2 | 177.9° | 179.9° |
| C10 | CD1 | CE1 | CZ | 178.2° | 179.9° |
| C10 | CD1 | CG | H1 | 2.1° | 0.3° |
| C10 | CD1 | CE1 | H3 | 1.8° | 0.0° |
| CD1 | C10 | H6 | H7 | 119.6° | 120.1° |
| CD1 | C10 | C11 | H8 | 69.3° | 60.0° |
| CD1 | C10 | C11 | H9 | 173.2° | 60.0° |
| O3 | C2 | N1 | H10 | 173.0° | 180.0° |
| O3 | C2 | O1 | H11 | 0.0° | 0.1° |
| CD1 | CG | CD2 | H1 | 180.0° | 179.8° |
| CG | CD1 | CE1 | CZ | 0.1° | 0.0° |
| CD1 | CG | CD2 | CE2 | 0.4° | 0.3° |
| CD1 | CG | CD2 | H2 | 179.6° | 179.7° |
| CG | CD1 | CE1 | H3 | 180.0° | 179.9° |
| CG | CD1 | C10 | H6 | 50.1° | 150.0° |
| CG | CD1 | C10 | H7 | 169.9° | 30.0° |
| CE1 | CD1 | CG | CD2 | 0.3° | 0.0° |
| CD1 | CE1 | CZ | H3 | 180.0° | 179.9° |
| CD1 | CE1 | CZ | CE2 | 0.0° | 0.3° |
| CE1 | CD1 | CG | H1 | 179.7° | 179.8° |
| CD1 | CE1 | CZ | H5 | 180.0° | 180.0° |
| CE1 | CD1 | C10 | H6 | 131.7° | 29.9° |
| CE1 | CD1 | C10 | H7 | 11.9° | 150.0° |
| CG | CD2 | CE2 | H2 | 180.0° | 180.0° |
| CG | CD2 | CE2 | CZ | 0.4° | 0.6° |
| CG | CD2 | CE2 | H4 | 179.6° | 179.9° |
| CE1 | CZ | CE2 | CD2 | 0.2° | 0.6° |
| CE1 | CZ | CE2 | H5 | 180.0° | 179.7° |
| CE1 | CZ | CE2 | H4 | 179.8° | 180.0° |
| CD2 | CE2 | CZ | H4 | 180.0° | 179.3° |
| CE2 | CD2 | CG | H1 | 179.6° | 179.9° |
| CD2 | CE2 | CZ | H5 | 179.9° | 179.7° |
| CZ | CE2 | CD2 | H2 | 179.7° | 179.4° |
| CE2 | CZ | CE1 | H3 | 180.0° | 179.6° |
| O1 | C2 | N1 | H10 | 15.3° | 0.0° |
| H1 | CG | CD2 | H2 | 0.4° | 0.1° |
| H2 | CD2 | CE2 | H4 | 0.3° | 0.1° |
| H3 | CE1 | CZ | H5 | 0.0° | 0.0° |
| H4 | CE2 | CZ | H5 | 0.1° | 0.4° |
| H6 | C10 | C11 | H8 | 50.8° | 180.0° |
| H6 | C10 | C11 | H9 | 66.7° | 60.0° |
| H7 | C10 | C11 | H8 | 170.6° | 60.0° |
| H7 | C10 | C11 | H9 | 53.1° | 180.0° |
| H8 | C11 | N1 | H10 | 163.9° | 120.0° |
| H9 | C11 | N1 | H10 | 46.5° | 120.0° |
