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Geometry for CH3CONH2 (Acetamide) 1A' C1

1910171554
InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4) INChIKey=DLFVBJFMPXGRIB-UHFFFAOYSA-N

PBEPBE/cc-pVDZ


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -1.3798 -0.2912 -0.0011   -1.3470 0.4174 -0.0011
C2 0.0798 0.1520 -0.0066   0.0654 -0.1587 -0.0066
N3 0.9937 -0.8803 -0.0440   1.0708 0.7847 -0.0440
O4 0.4261 1.3317 0.0068   0.3012 -1.3654 0.0069
H5 -2.0089 0.5605 -0.3139   -2.0521 -0.3725 -0.3139
H6 -1.5612 -1.1562 -0.6701   -1.4476 1.2955 -0.6702
H7 -1.6803 -0.5858 1.0263   -1.6190 0.7386 1.0263
H8 1.9724 -0.6329 0.1123   2.0224 0.4479 0.1123
H9 0.7136 -1.8425 0.1448   0.8808 1.7686 0.1448
Atom - Atom Distances (Å)
  C1 C2 N3 O4 H5 H6 H7 H8 H9
C1 1.5254 2.4459 2.4280 1.1040 1.1085 1.1102 3.3715 2.6096
C2 1.5254 1.3793 1.2296 2.1503 2.2010 2.1700 2.0524 2.0982
N3 2.4459 1.3793 2.2843 3.3413 2.6449 2.8952 1.0216 1.0197
O4 2.4280 1.2296 2.2843 2.5743 3.2554 3.0254 2.5024 3.1902
H5 1.1040 2.1503 3.3413 2.5743 1.8095 1.7939 4.1781 3.6601
H6 1.1085 2.2010 2.6449 3.2554 1.8095 1.7938 3.6568 2.5119
H7 1.1102 2.1700 2.8952 3.0254 1.7939 1.7938 3.7656 2.8437
H8 3.3715 2.0524 1.0216 2.5024 4.1781 3.6568 3.7656 1.7460
H9 2.6096 2.0982 1.0197 3.1902 3.6601 2.5119 2.8437 1.7460
Maximum atom distance is 4.1781Å between atoms H5 and H8.
picture of Acetamide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C2 N3 114.624 C1 C2 O4 123.247
N3 C2 O4 122.124
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 C1 H5 108.666 C2 C1 H6 112.401
C2 C1 H7 109.837 C2 N3 H8 116.704
C2 N3 H9 121.277 H5 C1 H6 109.740
H5 C1 H7 108.222 H6 C1 H7 107.891
H8 N3 H9 117.602

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