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Geometry for CH3CH2Cl (Ethyl chloride) 1A' CS

1910171554
InChI=1S/C2H5Cl/c1-2-3/h2H2,1H3 INChIKey=HRYZWHHZPQKTII-UHFFFAOYSA-N

MP2/6-311G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 1.5056 0.6452 0.0000   1.5923 -0.3846 0.0000
C2 0.0000 0.8132 0.0000   0.4868 0.6514 0.0000
H3 1.9823 1.6299 0.0000   2.5636 0.1188 0.0000
H4 1.8357 0.0996 0.8853   1.5300 -1.0192 0.8853
H5 1.8357 0.0996 -0.8853   1.5300 -1.0192 -0.8853
Cl6 -0.8234 -0.7802 0.0000   -1.1266 -0.1320 0.0000
H7 -0.3449 1.3419 0.8883   0.5271 1.2813 0.8883
H8 -0.3449 1.3419 -0.8883   0.5271 1.2813 -0.8883
Atom - Atom Distances (Å)
  C1 C2 H3 H4 H5 Cl6 H7 H8
C1 1.5150 1.0940 1.0910 1.0910 2.7306 2.1677 2.1677
C2 1.5150 2.1440 2.1593 2.1593 1.7935 1.0897 1.0897
H3 1.0940 2.1440 1.7740 1.7740 3.6987 2.5076 2.5076
H4 1.0910 2.1593 1.7740 1.7706 2.9374 2.5096 3.0731
H5 1.0910 2.1593 1.7740 1.7706 2.9374 3.0731 2.5096
Cl6 2.7306 1.7935 3.6987 2.9374 2.9374 2.3497 2.3497
H7 2.1677 1.0897 2.5076 2.5096 3.0731 2.3497 1.7765
H8 2.1677 1.0897 2.5076 3.0731 2.5096 2.3497 1.7765
Maximum atom distance is 3.6987Å between atoms H3 and Cl6.
picture of Ethyl chloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 Cl6 110.961
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 H7 111.614 C1 C2 H8 111.614
C2 C1 H3 109.462 C2 C1 H4 110.862
C2 C1 H5 110.862 H3 C1 H4 108.559
H3 C1 H5 108.559 H4 C1 H5 108.473
Cl6 C2 H7 106.602 Cl6 C2 H8 106.602
H7 C2 H8 109.201

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