Acrylonitrile
CAS Number: 107-13-1
Molecular Mass: 53.06 g/mol
Formula: C3H3N
Smiles: C=CC#N
Melting point: - °C
Boiling point: - °C
Density: - g/cm3
Dipole moment: - D
Refractive index: -
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 10.1572 |
| PMI2 | 101.2223 |
| PMI3 | 111.3795 |
| NPR1 | 0.0912 |
| NPR2 | 0.9088 |
| RadiusOfGyration | 1.4488 |
| InertialShapeFactor | 0.0895 |
| Eccentricity | 0.9958 |
| Asphericity | 0.7514 |
| SpherocityIndex | 0.0000 |
| PBF | 0.0000 |