data_FTM
# 
_chem_comp.id                                    FTM 
_chem_comp.name                                  2-fluoroacetamide 
_chem_comp.type                                  NON-POLYMER 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C2 H4 F N O" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2013-02-04 
_chem_comp.pdbx_modified_date                    2014-02-07 
_chem_comp.pdbx_ambiguous_flag                   N 
_chem_comp.pdbx_release_status                   REL 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        77.058 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     FTM 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        4IZT 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.alt_atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.charge 
_chem_comp_atom.pdbx_align 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_leaving_atom_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.model_Cartn_x 
_chem_comp_atom.model_Cartn_y 
_chem_comp_atom.model_Cartn_z 
_chem_comp_atom.pdbx_model_Cartn_x_ideal 
_chem_comp_atom.pdbx_model_Cartn_y_ideal 
_chem_comp_atom.pdbx_model_Cartn_z_ideal 
_chem_comp_atom.pdbx_component_atom_id 
_chem_comp_atom.pdbx_component_comp_id 
_chem_comp_atom.pdbx_ordinal 
FTM F  F  F 0 1 N N N 24.351 9.483  -8.939  -1.806 0.058  -0.000 F  FTM 1 
FTM C2 C2 C 0 1 N N N 25.349 10.374 -9.220  -0.690 -0.786 0.000  C2 FTM 2 
FTM C1 C1 C 0 1 N N N 25.110 11.807 -8.785  0.568  0.044  -0.000 C1 FTM 3 
FTM O  O  O 0 1 N N N 24.488 12.565 -9.526  0.496  1.254  -0.000 O  FTM 4 
FTM N  N  N 0 1 N N N 25.656 12.189 -7.628  1.773  -0.560 0.000  N  FTM 5 
FTM H1 H1 H 0 1 N N N 26.264 10.021 -8.722  -0.711 -1.415 0.890  H1 FTM 6 
FTM H2 H2 H 0 1 N N N 25.501 10.375 -10.309 -0.711 -1.415 -0.890 H2 FTM 7 
FTM H3 H3 H 0 1 N N N 25.569 13.138 -7.323  1.831  -1.528 0.000  H3 FTM 8 
FTM H4 H4 H 0 1 N N N 26.151 11.527 -7.066  2.583  -0.026 -0.000 H4 FTM 9 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
FTM O  C1 DOUB N N 1 
FTM C2 F  SING N N 2 
FTM C2 C1 SING N N 3 
FTM C1 N  SING N N 4 
FTM C2 H1 SING N N 5 
FTM C2 H2 SING N N 6 
FTM N  H3 SING N N 7 
FTM N  H4 SING N N 8 
# 
loop_
_pdbx_chem_comp_descriptor.comp_id 
_pdbx_chem_comp_descriptor.type 
_pdbx_chem_comp_descriptor.program 
_pdbx_chem_comp_descriptor.program_version 
_pdbx_chem_comp_descriptor.descriptor 
FTM SMILES           ACDLabs              12.01 "FCC(=O)N"                                  
FTM InChI            InChI                1.03  "InChI=1S/C2H4FNO/c3-1-2(4)5/h1H2,(H2,4,5)" 
FTM InChIKey         InChI                1.03  FVTWJXMFYOXOKK-UHFFFAOYSA-N                 
FTM SMILES_CANONICAL CACTVS               3.370 "NC(=O)CF"                                  
FTM SMILES           CACTVS               3.370 "NC(=O)CF"                                  
FTM SMILES_CANONICAL "OpenEye OEToolkits" 1.7.6 "C(C(=O)N)F"                                
FTM SMILES           "OpenEye OEToolkits" 1.7.6 "C(C(=O)N)F"                                
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
FTM "SYSTEMATIC NAME" ACDLabs              12.01 2-fluoroacetamide     
FTM "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.7.6 2-fluoranylethanamide 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
FTM "Create component" 2013-02-04 RCSB 
FTM "Initial release"  2014-02-12 RCSB 
#