KFG
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O04 | P03 | doub | 1.48Å | 1.49Å | |
O06 | P03 | sing | 1.61Å | 1.67Å | |
O06 | C07 | sing | 1.43Å | 1.36Å | |
O02 | C01 | sing | 1.43Å | 1.36Å | |
O02 | P03 | sing | 1.61Å | 1.67Å | |
P03 | O05 | sing | 1.61Å | 1.48Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C07 | H073 | sing | 1.09Å | 1.10Å | |
C07 | H071 | sing | 1.09Å | 1.10Å | |
C07 | H072 | sing | 1.09Å | 1.10Å | |
O05 | H1 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O04 | P03 | O06 | 106.6° | 109.5° |
O04 | P03 | O02 | 106.8° | 109.5° |
O04 | P03 | O05 | 127.2° | 109.5° |
P03 | O06 | C07 | 117.5° | 123.0° |
O06 | P03 | O02 | 100.3° | 109.5° |
O06 | P03 | O05 | 106.9° | 109.5° |
O06 | C07 | H073 | 109.5° | 109.5° |
O06 | C07 | H071 | 109.4° | 109.5° |
O06 | C07 | H072 | 109.5° | 109.5° |
C01 | O02 | P03 | 117.2° | 123.0° |
O02 | C01 | H012 | 109.5° | 109.5° |
O02 | C01 | H013 | 109.5° | 109.5° |
O02 | C01 | H011 | 109.4° | 109.5° |
O02 | P03 | O05 | 106.0° | 109.5° |
P03 | O05 | H1 | 109.5° | 114.0° |
H012 | C01 | H013 | 109.5° | 109.5° |
H012 | C01 | H011 | 109.5° | 109.4° |
H013 | C01 | H011 | 109.5° | 109.5° |
H073 | C07 | H071 | 109.5° | 109.5° |
H073 | C07 | H072 | 109.5° | 109.5° |
H071 | C07 | H072 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O04 | P03 | O06 | O02 | 111.1° | 120.0° |
O04 | P03 | O06 | O05 | 138.5° | 120.0° |
O04 | P03 | O06 | C07 | 129.8° | 55.0° |
O04 | P03 | O02 | C01 | 70.0° | 55.0° |
O04 | P03 | O02 | O05 | 138.0° | 120.0° |
O04 | P03 | O05 | H1 | 0.0° | 180.0° |
O06 | P03 | O02 | C01 | 179.0° | 175.0° |
O06 | P03 | O02 | O05 | 111.0° | 120.0° |
P03 | O06 | C07 | H073 | 180.0° | 60.0° |
P03 | O06 | C07 | H071 | 60.0° | 60.0° |
P03 | O06 | C07 | H072 | 60.0° | 180.0° |
O06 | P03 | O05 | H1 | 127.2° | 60.0° |
C07 | O06 | P03 | O02 | 119.0° | 175.0° |
C07 | O06 | P03 | O05 | 8.7° | 65.0° |
O06 | C07 | H073 | H071 | 120.0° | 120.0° |
O06 | C07 | H073 | H072 | 120.0° | 120.1° |
O06 | C07 | H071 | H072 | 120.0° | 120.0° |
C01 | O02 | P03 | O05 | 67.9° | 65.0° |
O02 | C01 | H012 | H013 | 120.0° | 120.0° |
O02 | C01 | H012 | H011 | 120.0° | 120.0° |
O02 | C01 | H013 | H011 | 120.0° | 120.1° |
P03 | O02 | C01 | H012 | 180.0° | 60.0° |
P03 | O02 | C01 | H013 | 60.0° | 60.0° |
P03 | O02 | C01 | H011 | 60.0° | 180.0° |
O02 | P03 | O05 | H1 | 126.4° | 60.0° |
H012 | C01 | H013 | H011 | 120.0° | 119.9° |
H073 | C07 | H071 | H072 | 120.0° | 120.0° |