ZG6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C08 | C06 | sing | 1.51Å | 1.52Å | |
N05 | C06 | sing | 1.35Å | 1.45Å | |
N05 | C04 | sing | 1.39Å | 1.45Å | |
C06 | O07 | doub | 1.21Å | 1.18Å | |
O10 | C04 | sing | 1.34Å | 1.34Å | Aromatic |
O10 | N11 | sing | 1.21Å | 1.36Å | Aromatic |
C04 | C03 | doub | 1.36Å | 1.39Å | Aromatic |
N11 | C02 | doub | 1.30Å | 1.33Å | Aromatic |
C03 | C02 | sing | 1.41Å | 1.38Å | Aromatic |
C02 | C01 | sing | 1.51Å | 1.53Å | |
C01 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C03 | H4 | sing | 1.08Å | 1.08Å | |
N05 | H5 | sing | 0.97Å | 1.00Å | |
C08 | H6 | sing | 1.09Å | 1.10Å | |
C08 | H7 | sing | 1.09Å | 1.10Å | |
C08 | H8 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C08 | C06 | N05 | 117.6° | 120.0° |
C08 | C06 | O07 | 120.4° | 120.0° |
C06 | C08 | H6 | 109.5° | 109.4° |
C06 | C08 | H7 | 109.5° | 109.5° |
C06 | C08 | H8 | 109.5° | 109.5° |
C06 | N05 | C04 | 121.5° | 120.1° |
N05 | C06 | O07 | 122.0° | 120.0° |
C06 | N05 | H5 | 119.3° | 119.9° |
N05 | C04 | O10 | 125.4° | 126.9° |
N05 | C04 | C03 | 126.7° | 126.9° |
C04 | N05 | H5 | 119.3° | 120.0° |
C04 | O10 | N11 | 108.0° | 111.5° |
O10 | C04 | C03 | 107.9° | 106.2° |
O10 | N11 | C02 | 109.6° | 111.9° |
C04 | C03 | C02 | 106.7° | 103.9° |
C04 | C03 | H4 | 126.6° | 128.0° |
N11 | C02 | C03 | 107.8° | 106.5° |
N11 | C02 | C01 | 127.1° | 126.8° |
C03 | C02 | C01 | 125.0° | 126.7° |
C02 | C03 | H4 | 126.6° | 128.1° |
C02 | C01 | H1 | 109.5° | 109.5° |
C02 | C01 | H2 | 109.4° | 109.4° |
C02 | C01 | H3 | 109.4° | 109.5° |
H1 | C01 | H2 | 109.5° | 109.5° |
H1 | C01 | H3 | 109.5° | 109.5° |
H2 | C01 | H3 | 109.5° | 109.5° |
H6 | C08 | H7 | 109.5° | 109.5° |
H6 | C08 | H8 | 109.5° | 109.4° |
H7 | C08 | H8 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C08 | C06 | N05 | O07 | 179.0° | 180.0° |
C08 | C06 | N05 | C04 | 179.4° | 179.9° |
C08 | C06 | N05 | H5 | 0.6° | 0.0° |
C06 | C08 | H6 | H7 | 120.0° | 120.0° |
C06 | C08 | H6 | H8 | 120.0° | 120.0° |
C06 | C08 | H7 | H8 | 120.0° | 120.0° |
C06 | N05 | C04 | H5 | 180.0° | 179.9° |
C06 | N05 | C04 | O10 | 157.9° | 0.2° |
C06 | N05 | C04 | C03 | 23.2° | 180.0° |
N05 | C06 | C08 | H6 | 179.0° | 60.0° |
N05 | C06 | C08 | H7 | 59.0° | 179.9° |
N05 | C06 | C08 | H8 | 61.0° | 60.0° |
C04 | N05 | C06 | O07 | 0.4° | 0.1° |
N05 | C04 | O10 | C03 | 179.1° | 179.9° |
N05 | C04 | O10 | N11 | 179.4° | 179.6° |
N05 | C04 | C03 | C02 | 179.1° | 179.9° |
N05 | C04 | C03 | H4 | 0.8° | 0.2° |
O07 | C06 | N05 | H5 | 179.6° | 180.0° |
O07 | C06 | C08 | H6 | 0.0° | 120.0° |
O07 | C06 | C08 | H7 | 120.0° | 0.0° |
O07 | C06 | C08 | H8 | 120.0° | 120.1° |
C04 | O10 | N11 | C02 | 2.5° | 0.4° |
O10 | C04 | C03 | C02 | 0.0° | 0.1° |
O10 | C04 | C03 | H4 | 179.9° | 180.0° |
O10 | C04 | N05 | H5 | 22.1° | 179.9° |
N11 | O10 | C04 | C03 | 1.5° | 0.2° |
O10 | N11 | C02 | C03 | 2.5° | 0.5° |
O10 | N11 | C02 | C01 | 179.6° | 179.8° |
C04 | C03 | C02 | N11 | 1.5° | 0.3° |
C04 | C03 | C02 | H4 | 180.0° | 179.9° |
C04 | C03 | C02 | C01 | 179.4° | 180.0° |
C03 | C04 | N05 | H5 | 156.8° | 0.1° |
N11 | C02 | C03 | C01 | 178.0° | 179.7° |
N11 | C02 | C01 | H1 | 0.0° | 90.3° |
N11 | C02 | C01 | H2 | 120.0° | 29.7° |
N11 | C02 | C01 | H3 | 120.0° | 149.7° |
N11 | C02 | C03 | H4 | 178.5° | 179.8° |
C03 | C02 | C01 | H1 | 177.6° | 90.0° |
C03 | C02 | C01 | H2 | 62.4° | 150.0° |
C03 | C02 | C01 | H3 | 57.6° | 30.0° |
C02 | C01 | H1 | H2 | 120.0° | 119.9° |
C02 | C01 | H1 | H3 | 120.0° | 120.0° |
C02 | C01 | H2 | H3 | 120.0° | 120.0° |
C01 | C02 | C03 | H4 | 0.6° | 0.1° |
H1 | C01 | H2 | H3 | 120.0° | 120.0° |
H6 | C08 | H7 | H8 | 120.0° | 120.0° |