GM7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N01 | C02 | sing | 1.39Å | 1.45Å | |
C02 | C03 | doub | 1.39Å | 1.38Å | Aromatic |
C02 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
O12 | C10 | doub | 1.21Å | 1.25Å | |
C03 | C04 | sing | 1.38Å | 1.38Å | Aromatic |
C13 | C09 | doub | 1.39Å | 1.39Å | Aromatic |
C04 | C05 | doub | 1.39Å | 1.39Å | Aromatic |
C09 | C05 | sing | 1.41Å | 1.38Å | Aromatic |
C09 | C10 | sing | 1.48Å | 1.53Å | |
O08 | C06 | doub | 1.22Å | 1.26Å | |
C05 | C06 | sing | 1.48Å | 1.53Å | |
C10 | O11 | sing | 1.35Å | 1.25Å | |
C06 | O07 | sing | 1.35Å | 1.26Å | |
C13 | H1 | sing | 1.08Å | 1.08Å | |
C03 | H2 | sing | 1.08Å | 1.08Å | |
C04 | H3 | sing | 1.08Å | 1.08Å | |
N01 | H4 | sing | 0.97Å | 1.00Å | |
N01 | H5 | sing | 0.97Å | 1.00Å | |
O07 | H6 | sing | 0.97Å | 0.95Å | |
O11 | H7 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N01 | C02 | C03 | 119.9° | 119.9° |
N01 | C02 | C13 | 119.8° | 119.9° |
C02 | N01 | H4 | 109.5° | 120.0° |
C02 | N01 | H5 | 109.4° | 120.0° |
C03 | C02 | C13 | 120.4° | 120.2° |
C02 | C03 | C04 | 119.3° | 120.3° |
C02 | C03 | H2 | 120.4° | 119.8° |
C02 | C13 | C09 | 120.3° | 120.0° |
C02 | C13 | H1 | 119.8° | 120.0° |
O12 | C10 | C09 | 120.5° | 120.0° |
O12 | C10 | O11 | 120.3° | 120.0° |
C03 | C04 | C05 | 120.6° | 120.1° |
C04 | C03 | H2 | 120.4° | 119.9° |
C03 | C04 | H3 | 119.7° | 119.9° |
C13 | C09 | C05 | 119.5° | 119.6° |
C13 | C09 | C10 | 117.8° | 120.2° |
C09 | C13 | H1 | 119.9° | 120.0° |
C04 | C05 | C09 | 120.0° | 119.8° |
C04 | C05 | C06 | 118.0° | 120.1° |
C05 | C04 | H3 | 119.7° | 120.0° |
C05 | C09 | C10 | 122.7° | 120.2° |
C09 | C05 | C06 | 122.0° | 120.1° |
C09 | C10 | O11 | 119.2° | 120.0° |
O08 | C06 | C05 | 120.0° | 120.0° |
O08 | C06 | O07 | 120.4° | 120.0° |
C05 | C06 | O07 | 119.6° | 120.0° |
C10 | O11 | H7 | 109.5° | 117.0° |
C06 | O07 | H6 | 109.5° | 117.0° |
H4 | N01 | H5 | 109.5° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N01 | C02 | C03 | C13 | 179.2° | 180.0° |
N01 | C02 | C03 | C04 | 180.0° | 179.9° |
N01 | C02 | C13 | C09 | 179.7° | 180.0° |
N01 | C02 | C13 | H1 | 0.3° | 0.3° |
N01 | C02 | C03 | H2 | 0.0° | 0.1° |
C02 | N01 | H4 | H5 | 120.0° | 180.0° |
C02 | C03 | C04 | H2 | 180.0° | 179.9° |
C03 | C02 | C13 | C09 | 0.5° | 0.0° |
C02 | C03 | C04 | C05 | 0.3° | 0.1° |
C03 | C02 | C13 | H1 | 179.5° | 179.7° |
C02 | C03 | C04 | H3 | 179.8° | 179.9° |
C03 | C02 | N01 | H4 | 180.0° | 0.0° |
C03 | C02 | N01 | H5 | 60.0° | 180.0° |
C13 | C02 | C03 | C04 | 0.8° | 0.1° |
C02 | C13 | C09 | H1 | 180.0° | 179.7° |
C02 | C13 | C09 | C05 | 0.9° | 0.0° |
C02 | C13 | C09 | C10 | 179.4° | 179.7° |
C13 | C02 | C03 | H2 | 179.2° | 179.9° |
C13 | C02 | N01 | H4 | 0.8° | 180.0° |
C13 | C02 | N01 | H5 | 119.2° | 0.0° |
O12 | C10 | C09 | C13 | 124.9° | 173.8° |
O12 | C10 | C09 | C05 | 53.5° | 6.5° |
O12 | C10 | C09 | O11 | 178.4° | 179.7° |
O12 | C10 | O11 | H7 | 0.0° | 0.3° |
C03 | C04 | C05 | H3 | 180.0° | 180.0° |
C03 | C04 | C05 | C09 | 1.6° | 0.1° |
C03 | C04 | C05 | C06 | 178.9° | 180.0° |
C13 | C09 | C05 | C04 | 2.0° | 0.0° |
C13 | C09 | C05 | C10 | 178.4° | 179.7° |
C13 | C09 | C05 | C06 | 179.1° | 179.9° |
C13 | C09 | C10 | O11 | 53.5° | 5.9° |
C04 | C05 | C09 | C06 | 177.1° | 179.9° |
C04 | C05 | C09 | C10 | 179.7° | 179.8° |
C04 | C05 | C06 | O08 | 45.0° | 125.0° |
C04 | C05 | C06 | O07 | 132.9° | 55.0° |
C05 | C04 | C03 | H2 | 179.7° | 180.0° |
C09 | C05 | C06 | O08 | 137.8° | 55.2° |
C05 | C09 | C10 | O11 | 128.1° | 173.8° |
C09 | C05 | C06 | O07 | 44.3° | 124.8° |
C05 | C09 | C13 | H1 | 179.1° | 179.7° |
C09 | C05 | C04 | H3 | 178.4° | 179.9° |
C10 | C09 | C05 | C06 | 2.5° | 0.4° |
C10 | C09 | C13 | H1 | 0.6° | 0.0° |
C09 | C10 | O11 | H7 | 178.4° | 180.0° |
O08 | C06 | C05 | O07 | 177.9° | 180.0° |
O08 | C06 | O07 | H6 | 0.0° | 0.0° |
C06 | C05 | C04 | H3 | 1.1° | 0.1° |
C05 | C06 | O07 | H6 | 177.9° | 180.0° |
H2 | C03 | C04 | H3 | 0.3° | 0.1° |