| Formula | HF |
| MW | 20.01 |
| InChIKey | KRHYYFGTRYWZRS-UHFFFAOYNA-N |
| Entry_Date | 2023-11-01 |
| Net_Charge | 0 |
| Number_Atoms | 2 |
| Number_Heavy_Atoms | 1 |
| Number_Rings | 0 |
| Number_Bonds | 1 |
| Rotat_Bonds | 0 |
| Unbranched_Chain | 1 |
| Chiral_Centers | 0 |
| ONatoms | 0 |
| HB_Donor | 0 |
| HB_Acceptor | 0 |
| OpenEye_HB_Donors | 0 |
| OpenEye_HB_Acceptors | 0 |
| Lipinski_HB_Donors | 0 |
| Lipinski_HB_Acceptors | 0 |
| Lipinski_Violations | 0 |
| XLogP3 | 0 |
| XLogP | 0.31 |
| logP | 0.5327 |
| PSA | 0 |
| MR | 2.22 |
| ABS | 0.55 |
| Solubility | soluble |
| Aggregator | Pass |
| PM7_Heat_of_Formation_kcal_per_mol | -60.81676 |
| PM7_Total_Energy_ev | -479.48188 |
| PM7_Electronic_Energy_ev | -557.6444 |
| PM7_Dipole_Debye | 1.52445 |
| PM7_Point_Group | C*v |
| PM7_HOMO_Energy_ev | -15.697 |
| PM7_LUMO_Energy_ev | 4.297 |
| PM7_COSMO_Area_square_ang | 39.65 |
| PM7_COSMO_Volue_cubic_ang | 23.15 |
| PM7_Electron_Affinity_ev | -4.297 |
| PM7_Ionization_Energy_ev | 15.697 |
| PM7_Energy_Gap_ev | 19.994 |
| PM7_Global_Hardness_ev | 9.997 |
| PM7_Global_Softness_ev | 0.10003000900270081 |
| PM7_Chemical_Potential_ev | -5.7 |
| PM7_Electronigativity_ev | 5.7 |
| PM7_Back_Donation_Energy_ev | -2.49925 |
| PM7_Electrophilicity_ev | 1.6249874962488746 |
| OPENEYE_Name | hydrogen fluoride |
| SMILES | F |
| Canonical_SMILES | F |
| InChI | 1/FH/h1H |
| InChI_3D | 1S/FH/h1H |
| AuxInfo | 1/0/N:1/rA:2nFH/rB:s1;/rC:;.5,0,0; |
| Duplicates | ChEBI29228;ChEBI30234_s0 |
| mol2_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29228.mol2 |
| pdbqt_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29228.pdbqt |
| sdf_Path | /CCDB/ChEBI/Database/Compound-0000000000-0000049999/Compound-0000029000-0000029249/ChEBI29228.sdf |