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Geometry for CH3PH2 (Methyl phosphine) 1A' CS

1910171554
InChI=1S/CH5P/c1-2/h2H2,1H3 INChIKey=SAWKFRBJGLMMES-UHFFFAOYSA-N

B3PW91/cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0713 1.1927 0.0000   -0.0028 0.0712 1.1927
P2 0.0713 -0.6769 0.0000   -0.0028 0.0712 -0.6769
H3 -0.9338 1.6369 0.0000   0.0370 -0.9331 1.6369
H4 0.6190 1.5432 0.8880   0.8628 0.6537 1.5432
H5 0.6190 1.5432 -0.8880   -0.9119 0.5833 1.5432
H6 -0.9004 -0.8630 -1.0396   -1.0031 -0.9409 -0.8630
H7 -0.9004 -0.8630 1.0396   1.0745 -0.8584 -0.8630
Atom - Atom Distances (Å)
  C1 P2 H3 H4 H5 H6 H7
C1 1.8696 1.0989 1.1007 1.1007 2.5001 2.5001
P2 1.8696 2.5226 2.4530 2.4530 1.4351 1.4351
H3 1.0989 2.5226 1.7913 1.7913 2.7076 2.7076
H4 1.1007 2.4530 1.7913 1.7761 3.4371 2.8497
H5 1.1007 2.4530 1.7913 1.7761 2.8497 3.4371
H6 2.5001 1.4351 2.7076 3.4371 2.8497 2.0791
H7 2.5001 1.4351 2.7076 2.8497 3.4371 2.0791
Maximum atom distance is 3.4371Å between atoms H4 and H6.
picture of Methyl phosphine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 P2 H6 97.450 C1 P2 H7 97.450
P2 C1 H3 113.841 P2 C1 H4 108.568
P2 C1 H5 108.568 H3 C1 H4 109.054
H3 C1 H5 109.054 H4 C1 H5 107.573
H6 P2 H7 92.839

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