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Geometry for NHF2 (difluoramine) 1A' CS

1910171554
InChI=1S/F2HN/c1-3-2/h3H INChIKey=ULFHSQLFQYTZLS-UHFFFAOYSA-N

B2PLYP/6-31G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0380 0.5915 0.0000   0.0720 0.5871 0.0380
H2 -0.9506 0.8707 0.0000   0.1060 0.8642 -0.9506
F3 0.0380 -0.2784 1.1020   1.0599 -0.4105 0.0380
F4 0.0380 -0.2784 -1.1020   -1.1277 -0.1422 0.0380
Atom - Atom Distances (Å)
  N1 H2 F3 F4
N1 1.0273 1.4040 1.4040
H2 1.0273 1.8741 1.8741
F3 1.4040 1.8741 2.2041
F4 1.4040 1.8741 2.2041
Maximum atom distance is 2.2041Å between atoms F3 and F4.
picture of difluoramine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F3 N1 F4 103.426
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 N1 F3 99.692 H2 N1 F4 99.692

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.