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Geometry for C5H10 (Cyclopentane) 1A C1

1910171554
InChI=1S/C5H10/c1-2-4-5-3-1/h1-5H2 INChIKey=RGSFGYAAUTVSQA-UHFFFAOYSA-N

MP2/Def2TZVPP


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.9112 -0.8464 0.2697   -0.9897 0.7535 -0.2686
C2 -0.2011 1.2651 0.1323   0.3241 -1.2391 -0.1343
C3 -1.2863 0.1683 0.0150   1.2966 -0.0415 -0.0149
C4 -0.5221 -1.1623 -0.1618   0.4057 1.2076 0.1638
C5 1.1092 0.5723 -0.2554   -1.0478 -0.6787 0.2542
H6 -0.1344 1.6164 1.1620   0.2923 -1.5936 -1.1646
H7 -0.4157 2.1305 -0.4919   0.6223 -2.0804 0.4885
H8 -1.9488 0.3518 -0.8287   1.9738 -0.1605 0.8287
H9 -1.9075 0.1463 0.9086   1.9128 0.0428 -0.9083
H10 -0.5244 -1.4588 -1.2111   0.3788 1.5012 1.2136
H11 -0.9655 -1.9767 0.4083   0.7672 2.0624 -0.4048
H12 1.6377 -1.5570 -0.1216   -1.7823 1.3889 0.1236
H13 0.9888 -0.8504 1.3589   -1.0671 0.7517 -1.3578
H14 1.2184 0.5475 -1.3415   -1.1590 -0.6664 1.3402
H15 1.9863 1.0680 0.1578   -1.8721 -1.2571 -0.1601
Atom - Atom Distances (Å)
  C1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11 H12 H13 H14 H15
C1 2.3905 2.4338 1.5298 1.5257 2.8205 3.3470 3.2896 3.0559 2.1514 2.1951 1.0889 1.0920 2.1525 2.1985
C2 2.3905 1.5473 2.4661 1.5321 1.0900 1.0884 2.1937 2.1831 3.0543 3.3421 3.3779 2.7196 2.1684 2.1965
C3 2.4338 1.5473 1.5446 2.4443 2.1770 2.2057 1.0884 1.0886 2.1752 2.2042 3.3978 2.8319 2.8735 3.3970
C4 1.5298 2.4661 1.5446 2.3830 3.1022 3.3110 2.1847 2.1857 1.0904 1.0885 2.1959 2.1662 2.7100 3.3716
C5 1.5257 1.5321 2.4443 2.3830 2.1554 2.1930 3.1191 3.2614 2.7762 3.3529 2.1980 2.1552 1.0918 1.0889
H6 2.8205 1.0900 2.1770 3.1022 2.1554 1.7546 2.9756 2.3171 3.9039 3.7642 3.8547 2.7177 3.0397 2.4097
H7 3.3470 1.0884 2.2057 3.3110 2.1930 1.7546 2.3723 2.8503 3.6623 4.2405 4.2369 3.7794 2.4285 2.7056
H8 3.2896 2.1937 1.0884 2.1847 3.1191 2.9756 2.3723 1.7499 2.3353 2.8140 4.1239 3.8549 3.2144 4.1196
H9 3.0559 2.1831 1.0886 2.1857 3.2614 2.3171 2.8503 1.7499 2.9971 2.3759 4.0658 3.0959 3.8723 4.0712
H10 2.1514 3.0543 2.1752 1.0904 2.7762 3.9039 3.6623 2.3353 2.9971 1.7565 2.4230 3.0438 2.6607 3.8160
H11 2.1951 3.3421 2.2042 1.0885 3.3529 3.7642 4.2405 2.8140 2.3759 1.7565 2.6894 2.4477 3.7686 4.2480
H12 1.0889 3.3779 3.3978 2.1959 2.1980 3.8547 4.2369 4.1239 4.0658 2.4230 2.6894 1.7641 2.4684 2.6627
H13 1.0920 2.7196 2.8319 2.1662 2.1552 2.7177 3.7794 3.8549 3.0959 3.0438 2.4477 1.7641 3.0494 2.4735
H14 2.1525 2.1684 2.8735 2.7100 1.0918 3.0397 2.4285 3.2144 3.8723 2.6607 3.7686 2.4684 3.0494 1.7631
H15 2.1985 2.1965 3.3970 3.3716 1.0889 2.4097 2.7056 4.1196 4.0712 3.8160 4.2480 2.6627 2.4735 1.7631
Maximum atom distance is 4.2480Å between atoms H11 and H15.
picture of Cyclopentane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C4 C3 104.679 C1 C5 C2 102.850
C2 C3 C4 105.804 C3 C2 C5 105.074
C4 C1 C5 102.506
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C4 H10 109.237 C1 C4 H11 112.857
C1 C5 H14 109.522 C1 C5 H15 113.404
C2 C3 H8 111.481 C2 C3 H9 110.630
C2 C5 H14 110.337 C2 C5 H15 112.772
C3 C2 H6 110.058 C3 C2 H7 112.453
C3 C4 H10 110.084 C3 C4 H11 112.526
C4 C1 H12 112.893 C4 C1 H13 110.311
C4 C3 H8 110.958 C4 C3 H9 111.032
C5 C1 H12 113.365 C5 C1 H13 109.723
C5 C2 H6 109.419 C5 C2 H7 112.519
H6 C2 H7 107.311 H8 C3 H9 107.000
H10 C4 H11 107.435 H12 C1 H13 107.972
H14 C5 H15 107.895

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