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Geometry for NH2CONH2 (Urea) 1A C2

1910171554
InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4) INChIKey=XSQUKJJJFZCRTK-UHFFFAOYSA-N

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Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.1445   0.1445 0.0000 0.0000
O2 0.0000 0.0000 1.3613   1.3613 0.0000 0.0000
N3 0.0000 1.1621 -0.6114   -0.6114 1.1619 -0.0197
N4 0.0000 -1.1621 -0.6114   -0.6114 -1.1619 0.0197
H5 0.1867 1.9958 -0.0740   -0.0740 1.9987 0.1528
H6 0.4285 1.1416 -1.5252   -1.5252 1.1487 0.4091
H7 -0.1867 -1.9958 -0.0740   -0.0740 -1.9987 -0.1528
H8 -0.4285 -1.1416 -1.5252   -1.5252 -1.1487 -0.4091
Atom - Atom Distances (Å)
  C1 O2 N3 N4 H5 H6 H7 H8
C1 1.2169 1.3862 1.3862 2.0164 2.0675 2.0164 2.0675
O2 1.2169 2.2895 2.2895 2.4654 3.1335 2.4654 3.1335
N3 1.3862 2.2895 2.3241 1.0094 1.0095 3.2087 2.5151
N4 1.3862 2.2895 2.3241 3.2087 2.5151 1.0094 1.0095
H5 2.0164 2.4654 1.0094 3.2087 1.7012 4.0091 3.5111
H6 2.0675 3.1335 1.0095 2.5151 1.7012 3.5111 2.4388
H7 2.0164 2.4654 3.2087 1.0094 4.0091 3.5111 1.7012
H8 2.0675 3.1335 2.5151 1.0095 3.5111 2.4388 1.7012
Maximum atom distance is 4.0091Å between atoms H5 and H7.
picture of Urea
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 C1 N3 123.041 O2 C1 N4 123.041
N3 C1 N4 113.917
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 113.713 C1 N3 H6 118.461
C1 N4 H7 113.713 C1 N4 H8 118.461
H5 N3 H6 114.844 H7 N4 H8 114.844

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