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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

B3LYP/CEP-121G*


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.7447 -1.0264 0.2579   -0.6396 -1.0956 0.2554
C2 0.0436 1.3004 0.1260   -0.1719 1.2894 0.1291
C3 -1.2478 0.4182 0.0144   1.2003 0.5394 0.0155
C4 -0.7496 -1.0558 -0.1545   0.8503 -0.9762 -0.1569
C5 1.2211 0.3576 -0.2440   -1.2505 0.2358 -0.2433
H6 0.1686 1.6563 1.1582   -0.3314 1.6287 1.1621
H7 0.0016 2.1908 -0.5140   -0.2182 2.1812 -0.5088
H8 -1.8713 0.7227 -0.8357   1.7906 0.9061 -0.8337
H9 -1.8695 0.5247 0.9126   1.8086 0.7047 0.9141
H10 -0.8307 -1.3631 -1.2069   0.9612 -1.2714 -1.2101
H11 -1.3396 -1.7707 0.4333   1.5082 -1.6306 0.4292
H12 1.3208 -1.8632 -0.1585   -1.1302 -1.9843 -0.1631
H13 0.8388 -1.0769 1.3539   -0.7280 -1.1578 1.3512
H14 1.3566 0.3272 -1.3361   -1.3825 0.1947 -1.3354
H15 2.1764 0.6760 0.1939   -2.2325 0.4572 0.1953
Atom - Atom Distances (Å)
  C1 C2 C3 C4 C5 H6 H7 H8 H9 H10 H11 H12 H13 H14 H15
C1 2.4337 2.4731 1.5505 1.5474 2.8877 3.3909 3.3315 3.1095 2.1774 2.2202 1.0980 1.1011 2.1789 2.2253
C2 2.4337 1.5680 2.5019 1.5531 1.0989 1.0974 2.2194 2.2092 3.1040 3.3822 3.4235 2.7913 2.1928 2.2233
C3 2.4731 1.5680 1.5650 2.4831 2.2016 2.2321 1.0973 1.0976 2.1996 2.2305 3.4398 2.8954 2.9351 3.4386
C4 1.5505 2.5019 1.5650 2.4269 3.1498 3.3518 2.2102 2.2115 1.0994 1.0975 2.2224 2.1906 2.7830 3.4179
C5 1.5474 1.5531 2.4831 2.4269 2.1818 2.2182 3.1697 3.3042 2.8457 3.3979 2.2248 2.1811 1.1009 1.0980
H6 2.8877 1.0989 2.2016 3.1498 2.1818 1.7634 3.0014 2.3441 3.9634 3.8137 3.9304 2.8209 3.0657 2.4335
H7 3.3909 1.0974 2.2321 3.3518 2.2182 1.7634 2.4014 2.8831 3.7152 4.2883 4.2781 3.8559 2.4463 2.7432
H8 3.3315 2.2194 1.0973 2.2102 3.1697 3.0014 2.4014 1.7595 2.3603 2.8477 4.1636 3.9214 3.2903 4.1769
H9 3.1095 2.2092 1.0976 2.2115 3.3042 2.3441 2.8831 1.7595 3.0224 2.4040 4.1265 3.1772 3.9374 4.1120
H10 2.1774 3.1040 2.1996 1.0994 2.8457 3.9634 3.7152 2.3603 3.0224 1.7650 2.4451 3.0702 2.7673 3.8940
H11 2.2202 3.3822 2.2305 1.0975 3.3979 3.8137 4.2883 2.8477 2.4040 1.7650 2.7271 2.4646 3.8473 4.2903
H12 1.0980 3.4235 3.4398 2.2224 2.2248 3.9304 4.2781 4.1636 4.1265 2.4451 2.7271 1.7715 2.4872 2.7026
H13 1.1011 2.7913 2.8954 2.1906 2.1811 2.8209 3.8559 3.9214 3.1772 3.0702 2.4646 1.7715 3.0782 2.4915
H14 2.1789 2.1928 2.9351 2.7830 1.1009 3.0657 2.4463 3.2903 3.9374 2.7673 3.8473 2.4872 3.0782 1.7705
H15 2.2253 2.2233 3.4386 3.4179 1.0980 2.4335 2.7432 4.1769 4.1120 3.8940 4.2903 2.7026 2.4915 1.7705
Maximum atom distance is 4.2903Å 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 105.081 C1 C5 C2 103.429
C2 C3 C4 105.988 C3 C2 C5 105.424
C4 C1 C5 103.146
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 C4 H10 109.329 C1 C4 H11 112.833
C1 C5 H14 109.570 C1 C5 H15 113.445
C2 C3 H8 111.533 C2 C3 H9 110.713
C2 C5 H14 110.264 C2 C5 H15 112.866
C3 C2 H6 110.043 C3 C2 H7 112.552
C3 C4 H10 110.064 C3 C4 H11 112.617
C4 C1 H12 112.974 C4 C1 H13 110.251
C4 C3 H8 111.016 C4 C3 H9 111.100
C5 C1 H12 113.399 C5 C1 H13 109.731
C5 C2 H6 109.517 C5 C2 H7 112.497
H6 C2 H7 106.819 H8 C3 H9 106.568
H10 C4 H11 106.915 H12 C1 H13 107.320
H14 C5 H15 107.251

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