YPT
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
PT2 | I2 | sing | 0.00Å | 2.30Å | |
PT2 | N3 | sing | 0.00Å | 2.46Å | |
PT2 | I1 | sing | 0.00Å | 2.49Å | |
N3 | H1 | sing | 0.00Å | 1.00Å | |
N3 | H2 | sing | 0.00Å | 1.00Å | |
PT2 | N1 | sing | 0.00Å | 18.89Å | |
N1 | H3 | sing | 0.00Å | 0.00Å | |
N1 | H4 | sing | 0.00Å | 0.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
I2 | PT2 | N3 | 91.0° | 90.0° |
I2 | PT2 | I1 | 90.0° | 90.0° |
I2 | PT2 | N1 | 95.4° | 90.0° |
N3 | PT2 | I1 | 178.0° | 90.0° |
PT2 | N3 | H1 | 109.5° | 90.0° |
PT2 | N3 | H2 | 109.5° | 90.0° |
N3 | PT2 | N1 | 118.0° | 90.0° |
I1 | PT2 | N1 | 60.2° | 90.0° |
H1 | N3 | H2 | 109.5° | 90.0° |
PT2 | N1 | H3 | 90.0° | 90.0° |
PT2 | N1 | H4 | 90.0° | 90.0° |
H3 | N1 | H4 | 90.0° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
I2 | PT2 | N3 | I1 | 119.2° | 90.0° |
I2 | PT2 | N3 | N1 | 96.6° | 90.0° |
I2 | PT2 | I1 | N1 | 96.2° | 90.0° |
I2 | PT2 | N3 | H1 | 180.0° | 90.0° |
I2 | PT2 | N3 | H2 | 60.0° | 90.0° |
I2 | PT2 | N1 | H3 | 90.0° | 90.0° |
I2 | PT2 | N1 | H4 | 90.0° | 90.0° |
N3 | PT2 | I1 | N1 | 23.0° | 90.0° |
PT2 | N3 | H1 | H2 | 120.0° | 90.0° |
N3 | PT2 | N1 | H3 | 90.0° | 90.0° |
N3 | PT2 | N1 | H4 | 90.0° | 90.0° |
I1 | PT2 | N3 | H1 | 60.8° | 90.0° |
I1 | PT2 | N3 | H2 | 59.2° | 90.0° |
I1 | PT2 | N1 | H3 | 90.0° | 90.0° |
I1 | PT2 | N1 | H4 | 90.0° | 90.0° |
H1 | N3 | PT2 | N1 | 83.4° | 90.0° |
H2 | N3 | PT2 | N1 | 36.6° | 90.0° |
PT2 | N1 | H3 | H4 | 90.0° | 90.0° |