8GL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O10 | C09 | doub | 1.21Å | 1.26Å | |
O07 | C06 | doub | 1.21Å | 1.27Å | |
C09 | O11 | sing | 1.34Å | 1.30Å | |
C09 | C02 | sing | 1.51Å | 1.60Å | |
C04 | C02 | sing | 1.53Å | 1.64Å | |
C04 | C05 | sing | 1.53Å | 1.44Å | |
C06 | C05 | sing | 1.51Å | 1.47Å | |
C06 | O08 | sing | 1.34Å | 1.29Å | |
N01 | C02 | sing | 1.47Å | 1.63Å | |
C02 | O03 | sing | 1.43Å | 1.40Å | |
N01 | H1 | sing | 1.01Å | 1.00Å | |
N01 | H2 | sing | 1.01Å | 1.00Å | |
O03 | H4 | sing | 0.97Å | 0.95Å | |
C04 | H5 | sing | 1.09Å | 1.10Å | |
C04 | H6 | sing | 1.09Å | 1.10Å | |
C05 | H7 | sing | 1.09Å | 1.10Å | |
C05 | H8 | sing | 1.09Å | 1.10Å | |
O08 | H9 | sing | 0.97Å | 0.95Å | |
O11 | H10 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O10 | C09 | O11 | 125.4° | 120.0° |
O10 | C09 | C02 | 125.5° | 120.1° |
O07 | C06 | C05 | 120.2° | 120.0° |
O07 | C06 | O08 | 124.9° | 120.0° |
O11 | C09 | C02 | 109.1° | 119.9° |
C09 | O11 | H10 | 109.5° | 117.0° |
C09 | C02 | C04 | 119.2° | 109.5° |
C09 | C02 | N01 | 110.9° | 109.5° |
C09 | C02 | O03 | 111.4° | 109.4° |
C02 | C04 | C05 | 104.3° | 109.5° |
C04 | C02 | N01 | 98.4° | 109.5° |
C04 | C02 | O03 | 118.6° | 109.5° |
C02 | C04 | H5 | 110.7° | 109.5° |
C02 | C04 | H6 | 110.7° | 109.4° |
C04 | C05 | C06 | 114.9° | 109.5° |
C05 | C04 | H5 | 110.7° | 109.5° |
C05 | C04 | H6 | 110.7° | 109.5° |
C04 | C05 | H7 | 108.1° | 109.5° |
C04 | C05 | H8 | 108.1° | 109.4° |
C05 | C06 | O08 | 114.9° | 120.0° |
C06 | C05 | H7 | 108.1° | 109.5° |
C06 | C05 | H8 | 108.1° | 109.5° |
C06 | O08 | H9 | 109.5° | 117.0° |
N01 | C02 | O03 | 93.9° | 109.5° |
C02 | N01 | H1 | 109.5° | 111.1° |
C02 | N01 | H2 | 109.5° | 111.0° |
C02 | O03 | H4 | 109.5° | 114.0° |
H1 | N01 | H2 | 109.5° | 110.9° |
H5 | C04 | H6 | 109.5° | 109.5° |
H7 | C05 | H8 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O10 | C09 | O11 | C02 | 180.0° | 180.0° |
O10 | C09 | C02 | C04 | 24.9° | 120.0° |
O10 | C09 | C02 | N01 | 138.0° | 120.0° |
O10 | C09 | C02 | O03 | 118.9° | 0.0° |
O10 | C09 | O11 | H10 | 0.0° | 0.1° |
O07 | C06 | C05 | C04 | 7.8° | 0.0° |
O07 | C06 | C05 | O08 | 179.8° | 180.0° |
O07 | C06 | C05 | H7 | 113.0° | 120.0° |
O07 | C06 | C05 | H8 | 128.6° | 120.0° |
O07 | C06 | O08 | H9 | 0.0° | 0.0° |
O11 | C09 | C02 | C04 | 155.0° | 60.1° |
O11 | C09 | C02 | N01 | 42.0° | 60.0° |
O11 | C09 | C02 | O03 | 61.1° | 180.0° |
C09 | C02 | C04 | N01 | 119.6° | 120.1° |
C09 | C02 | C04 | O03 | 141.3° | 119.9° |
C09 | C02 | C04 | C05 | 106.6° | 180.0° |
C09 | C02 | N01 | O03 | 114.6° | 119.9° |
C09 | C02 | N01 | H1 | 180.0° | 60.0° |
C09 | C02 | N01 | H2 | 60.0° | 63.9° |
C09 | C02 | O03 | H4 | 180.0° | 60.0° |
C09 | C02 | C04 | H5 | 12.6° | 59.9° |
C09 | C02 | C04 | H6 | 134.3° | 60.0° |
C02 | C09 | O11 | H10 | 179.9° | 180.0° |
C02 | C04 | C05 | H5 | 119.2° | 120.0° |
C02 | C04 | C05 | H6 | 119.2° | 120.0° |
C02 | C04 | C05 | C06 | 168.2° | 180.0° |
C04 | C02 | N01 | O03 | 119.7° | 120.0° |
C04 | C02 | N01 | H1 | 54.4° | 60.1° |
C04 | C02 | N01 | H2 | 65.7° | 176.0° |
C04 | C02 | O03 | H4 | 35.9° | 60.0° |
C02 | C04 | H5 | H6 | 122.4° | 119.9° |
C02 | C04 | C05 | H7 | 71.0° | 59.9° |
C02 | C04 | C05 | H8 | 47.5° | 60.0° |
C04 | C05 | C06 | H7 | 120.8° | 120.0° |
C04 | C05 | C06 | H8 | 120.8° | 120.0° |
C04 | C05 | C06 | O08 | 172.4° | 180.0° |
C05 | C04 | C02 | N01 | 133.8° | 60.0° |
C05 | C04 | C02 | O03 | 34.7° | 60.1° |
C05 | C04 | H5 | H6 | 122.4° | 120.0° |
C04 | C05 | H7 | H8 | 117.5° | 119.9° |
C06 | C05 | C04 | H5 | 49.0° | 60.0° |
C06 | C05 | C04 | H6 | 72.6° | 60.0° |
C06 | C05 | H7 | H8 | 117.5° | 120.0° |
C05 | C06 | O08 | H9 | 179.8° | 180.0° |
O08 | C06 | C05 | H7 | 66.8° | 60.0° |
O08 | C06 | C05 | H8 | 51.6° | 60.0° |
C02 | N01 | H1 | H2 | 120.0° | 124.0° |
N01 | C02 | O03 | H4 | 65.8° | 180.0° |
N01 | C02 | C04 | H5 | 107.0° | 180.0° |
N01 | C02 | C04 | H6 | 14.6° | 60.0° |
O03 | C02 | N01 | H1 | 65.3° | 179.9° |
O03 | C02 | N01 | H2 | 174.6° | 56.0° |
O03 | C02 | C04 | H5 | 153.9° | 60.0° |
O03 | C02 | C04 | H6 | 84.5° | 180.0° |
H5 | C04 | C05 | H7 | 169.8° | 180.0° |
H5 | C04 | C05 | H8 | 71.7° | 60.0° |
H6 | C04 | C05 | H7 | 48.2° | 60.0° |
H6 | C04 | C05 | H8 | 166.6° | 180.0° |