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Geometry for C6H15N (triethylamine) 1A C3

1910171554
InChI=1S/C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3 INChIKey=ZMANZCXQSJIPKH-UHFFFAOYSA-N

CID/6-31G*


Point group is C3
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.0255   0.0000 -0.0000 -0.0255
C2 -0.3237 1.3547 0.4543   -1.3153 0.4584 -0.4543
C3 -1.0114 -0.9577 0.4543   1.0546 0.9098 -0.4543
C4 1.3351 -0.3970 0.4543   0.2606 -1.3683 -0.4543
C5 0.2904 2.4139 -0.4464   -2.4309 -0.0460 0.4464
C6 -2.2357 -0.9554 -0.4464   1.1756 2.1282 0.4464
C7 1.9453 -1.4585 -0.4464   1.2552 -2.0822 0.4464
H8 -1.4035 1.4711 0.4263   -1.3224 1.5445 -0.4263
H9 -0.0253 1.5214 1.4981   -1.5111 0.1784 -1.4981
H10 -0.5723 -1.9511 0.4263   1.9988 0.3729 -0.4263
H11 -1.3049 -0.7826 1.4981   0.9100 1.2195 -1.4981
H12 1.9758 0.4799 0.4263   -0.6764 -1.9174 -0.4263
H13 1.3302 -0.7387 1.4981   0.6011 -1.3978 -1.4981
H14 1.3769 2.3723 -0.4478   -2.4989 -1.1311 0.4478
H15 -0.0511 2.2732 -1.4685   -2.2565 0.2797 1.4685
H16 0.0000 3.4097 -0.1156   -3.3924 0.3432 0.1156
H17 -2.7429 0.0062 -0.4478   0.2699 2.7296 0.4478
H18 -1.9431 -1.1809 -1.4685   1.3705 1.8144 1.4685
H19 -2.9529 -1.7049 -0.1156   1.9935 2.7663 0.1156
H20 1.3661 -2.3786 -0.4478   2.2290 -1.5986 0.4478
H21 1.9942 -1.0924 -1.4685   0.8861 -2.0941 1.4685
H22 2.9529 -1.7049 -0.1156   1.3989 -3.1095 0.1156
Atom - Atom Distances (Å)
  N1 C2 C3 C4 C5 C6 C7 H8 H9 H10 H11 H12 H13 H14 H15 H16 H17 H18 H19 H20 H21 H22
N1 1.4574 1.4574 1.4574 2.4767 2.4767 2.4767 2.0724 2.1175 2.0724 2.1175 2.0724 2.1175 2.7835 2.7207 3.4126 2.7835 2.7207 3.4126 2.7835 2.7207 3.4126
C2 1.4574 2.4125 2.4125 1.5200 3.1311 3.7247 1.0865 1.0982 3.3152 2.5730 2.4604 2.8649 2.1775 2.1483 2.1570 2.9129 3.5706 4.0741 4.1960 3.8805 4.5191
C3 1.4574 2.4125 2.4125 3.7247 1.5200 3.1311 2.4604 2.8649 1.0865 1.0982 3.3152 2.5730 4.1960 3.8805 4.5191 2.1775 2.1483 2.1570 2.9129 3.5706 4.0741
C4 1.4574 2.4125 2.4125 3.1311 3.7247 1.5200 3.3152 2.5730 2.4604 2.8649 1.0865 1.0982 2.9129 3.5706 4.0741 4.1960 3.8805 4.5191 2.1775 2.1483 2.1570
C5 2.4767 1.5200 3.7247 3.1311 4.2112 4.2112 2.1260 2.1627 4.5342 4.0674 2.7096 3.8472 1.0872 1.0868 1.0888 3.8727 4.3538 5.2529 4.9117 4.0301 4.9155
C6 2.4767 3.1311 1.5200 3.7247 4.2112 4.2112 2.7096 3.8472 2.1260 2.1627 4.5342 4.0674 4.9117 4.0301 4.9155 1.0872 1.0868 1.0888 3.8727 4.3538 5.2529
C7 2.4767 3.7247 3.1311 1.5200 4.2112 4.2112 4.5342 4.0674 2.7096 3.8472 2.1260 2.1627 3.8727 4.3538 5.2529 4.9117 4.0301 4.9155 1.0872 1.0868 1.0888
H8 2.0724 1.0865 2.4604 3.3152 2.1260 2.7096 4.5342 1.7466 3.5217 2.4976 3.5217 3.6750 3.0507 2.4622 2.4539 2.1688 3.3037 3.5750 4.8223 4.6590 5.4184
H9 2.1175 1.0982 2.8649 2.5730 2.1627 3.8472 4.0674 1.7466 3.6750 2.6355 2.4976 2.6355 2.5449 3.0605 2.4840 3.6698 4.4475 4.6457 4.5751 4.4397 4.6779
H10 2.0724 3.3152 1.0865 2.4604 4.5342 2.1260 2.7096 3.5217 3.6750 1.7466 3.5217 2.4976 4.8223 4.6590 5.4184 3.0507 2.4622 2.4539 2.1688 3.3037 3.5750
H11 2.1175 2.5730 1.0982 2.8649 4.0674 2.1627 3.8472 2.4976 2.6355 1.7466 3.6750 2.6355 4.5751 4.4397 4.6779 2.5449 3.0605 2.4840 3.6698 4.4475 4.6457
H12 2.0724 2.4604 3.3152 1.0865 2.7096 4.5342 2.1260 3.5217 2.4976 3.5217 3.6750 1.7466 2.1688 3.3037 3.5750 4.8223 4.6590 5.4184 3.0507 2.4622 2.4539
H13 2.1175 2.8649 2.5730 1.0982 3.8472 4.0674 2.1627 3.6750 2.6355 2.4976 2.6355 1.7466 3.6698 4.4475 4.6457 4.5751 4.4397 4.6779 2.5449 3.0605 2.4840
H14 2.7835 2.1775 4.1960 2.9129 1.0872 4.9117 3.8727 3.0507 2.5449 4.8223 4.5751 2.1688 3.6698 1.7580 1.7557 4.7509 4.9688 5.9566 4.7509 3.6643 4.3838
H15 2.7207 2.1483 3.8805 3.5706 1.0868 4.0301 4.3538 2.4622 3.0605 4.6590 4.4397 3.3037 4.4475 1.7580 1.7677 3.6643 3.9383 5.1065 4.9688 3.9383 5.1652
H16 3.4126 2.1570 4.5191 4.0741 1.0888 4.9155 5.2529 2.4539 2.4840 5.4184 4.6779 3.5750 4.6457 1.7557 1.7677 4.3838 5.1652 5.9058 5.9566 5.1065 5.9058
H17 2.7835 2.9129 2.1775 4.1960 3.8727 1.0872 4.9117 2.1688 3.6698 3.0507 2.5449 4.8223 4.5751 4.7509 3.6643 4.3838 1.7580 1.7557 4.7509 4.9688 5.9566
H18 2.7207 3.5706 2.1483 3.8805 4.3538 1.0868 4.0301 3.3037 4.4475 2.4622 3.0605 4.6590 4.4397 4.9688 3.9383 5.1652 1.7580 1.7677 3.6643 3.9383 5.1065
H19 3.4126 4.0741 2.1570 4.5191 5.2529 1.0888 4.9155 3.5750 4.6457 2.4539 2.4840 5.4184 4.6779 5.9566 5.1065 5.9058 1.7557 1.7677 4.3838 5.1652 5.9058
H20 2.7835 4.1960 2.9129 2.1775 4.9117 3.8727 1.0872 4.8223 4.5751 2.1688 3.6698 3.0507 2.5449 4.7509 4.9688 5.9566 4.7509 3.6643 4.3838 1.7580 1.7557
H21 2.7207 3.8805 3.5706 2.1483 4.0301 4.3538 1.0868 4.6590 4.4397 3.3037 4.4475 2.4622 3.0605 3.6643 3.9383 5.1065 4.9688 3.9383 5.1652 1.7580 1.7677
H22 3.4126 4.5191 4.0741 2.1570 4.9155 5.2529 1.0888 5.4184 4.6779 3.5750 4.6457 2.4539 2.4840 4.3838 5.1652 5.9058 5.9566 5.1065 5.9058 1.7557 1.7677
Maximum atom distance is 5.9566Å between atoms H14 and H19.
picture of triethylamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 C2 C5 112.560 N1 C3 C6 112.560
N1 C4 C7 112.560 C2 N1 C3 111.724
C2 N1 C4 111.724 C3 N1 C4 111.724
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 C2 H8 108.225 N1 C2 H9 111.122
N1 C3 H10 108.225 N1 C3 H11 111.122
N1 C4 H12 108.225 N1 C4 H13 111.122
C2 C5 H14 112.203 C2 C5 H15 109.886
C2 C5 H16 110.458 C3 C6 H17 112.203
C3 C6 H18 109.886 C3 C6 H19 110.458
C4 C7 H20 112.203 C4 C7 H21 109.886
C4 C7 H22 110.458 C5 C2 H8 108.157
C5 C2 H9 110.344 C6 C3 H10 108.157
C6 C3 H11 110.344 C7 C4 H12 108.157
C7 C4 H13 110.344 H8 C2 H9 106.159
H10 C3 H11 106.159 H12 C4 H13 106.159
H14 C5 H15 107.929 H14 C5 H16 107.574
H15 C5 H16 108.680 H17 C6 H18 107.929
H17 C6 H19 107.574 H18 C6 H19 108.680
H20 C7 H21 107.929 H20 C7 H22 107.574
H21 C7 H22 108.680

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