List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
365767 |
127318492 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-52.66 |
3.35 |
-8.92 |
-0.74 |
0 |
|
|
365768 |
127318493 |
1 |
OSN4C17H18 |
ABC4D17E18 |
28.53 |
1.34 |
-8.83 |
-0.78 |
0 |
|
|
365769 |
127318494 |
1 |
N2S2O3C17H20 |
A2B2C3D17E20 |
-102.88 |
7.1 |
-8.98 |
-0.81 |
0 |
|
|
365770 |
127318495 |
1 |
SN2O2C17H20 |
AB2C2D17E20 |
-64.7 |
3.49 |
-8.66 |
-0.44 |
0 |
|
|
365771 |
127318496 |
1 |
O2N3C19H19 |
A2B3C19D19 |
18.01 |
6.81 |
-9.61 |
-1.17 |
0 |
|
|
365772 |
127318497 |
1 |
SN2O3C17H24 |
AB2C3D17E24 |
-116.06 |
7.84 |
-9.42 |
0.22 |
0 |
|
|
365773 |
127318498 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-126.67 |
4.33 |
-8.98 |
0.21 |
0 |
|
|
365774 |
127318499 |
1 |
N3O3C17H19 |
A3B3C17D19 |
-106.77 |
2.35 |
-9.33 |
-1.03 |
0 |
|
|
365775 |
127318500 |
1 |
O3N4C21H22 |
A3B4C21D22 |
-76.31 |
3.66 |
-9.57 |
-1.48 |
0 |
|
|
365776 |
127318501 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-133.43 |
5.31 |
-9.34 |
-0.02 |
0 |
|
|
365777 |
127318502 |
1 |
ON4C20H22 |
AB4C20D22 |
33.44 |
3.75 |
-9.13 |
-0.65 |
0 |
|
|
365778 |
127318503 |
1 |
ON4C23H32 |
AB4C23D32 |
-18.0 |
2.74 |
-8.81 |
0.28 |
0 |
|
|
365779 |
127318504 |
1 |
N2O3C21H22 |
A2B3C21D22 |
-86.47 |
5.02 |
-9.11 |
-0.7 |
0 |
|
|
365780 |
127318505 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-39.41 |
1.89 |
-9.43 |
-0.48 |
0 |
|
|
365781 |
127318506 |
1 |
NSO3C19H27 |
ABC3D19E27 |
-135.87 |
5.65 |
-9.22 |
0.46 |
0 |
|
|
365782 |
127318507 |
1 |
SN2O3C18H26 |
AB2C3D18E26 |
-124.14 |
5.31 |
-9.48 |
0.22 |
0 |
|
|
365783 |
127318508 |
1 |
SN2O3C17H24 |
AB2C3D17E24 |
-120.61 |
4.45 |
-9.49 |
0.1 |
0 |
|
|
365784 |
127318509 |
1 |
NSO3C18H25 |
ABC3D18E25 |
-134.55 |
8.77 |
-9.57 |
0.14 |
0 |
|
|
365785 |
127318510 |
1 |
ON3C18H21 |
AB3C18D21 |
-2.11 |
4.27 |
-9.82 |
-0.89 |
0 |
|
|
365786 |
127318511 |
1 |
ON4C19H20 |
AB4C19D20 |
43.05 |
6.24 |
-9.24 |
-1.35 |
0 |
|
|
365787 |
127318512 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-7.24 |
2.46 |
-10.09 |
-1.28 |
0 |
|
|
365788 |
127318513 |
1 |
N3O3C19H33 |
A3B3C19D33 |
-165.35 |
4.33 |
-9.01 |
0.71 |
0 |
|
|
365789 |
127318514 |
1 |
SN3O4C18H29 |
AB3C4D18E29 |
-161.17 |
1.67 |
-9.68 |
-0.52 |
0 |
|
|
365790 |
127318515 |
1 |
O2N3C18H31 |
A2B3C18D31 |
-127.88 |
4.54 |
-9.05 |
1.13 |
0 |
|
|
365791 |
127318516 |
1 |
NSO3C13H23 |
ABC3D13E23 |
-166.87 |
8.5 |
-10.14 |
0.78 |
0 |
|
|
365792 |
127318517 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-85.86 |
6.7 |
-9.18 |
-0.9 |
0 |
|
|
365793 |
127318518 |
1 |
O2N6C19H24 |
A2B6C19D24 |
-5.57 |
8.8 |
-8.93 |
-0.74 |
0 |
|
|
365794 |
127318519 |
2 |
ON2C9H10 |
AB2C9D10 |
-8.51 |
4.64 |
-8.98 |
-0.76 |
0 |
|
|
365795 |
127318520 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-78.76 |
7.67 |
-9.11 |
-1.01 |
0 |
|
|
365796 |
127318521 |
1 |
SN2O4C20H30 |
AB2C4D20E30 |
-165.61 |
6.68 |
-9.35 |
-0.41 |
0 |
|
|
365797 |
127318522 |
2 |
ON2C11H13 |
AB2C11D13 |
-9.47 |
3.86 |
-8.8 |
-1.0 |
0 |
|
|
365798 |
127318523 |
1 |
SN2O4C14H26 |
AB2C4D14E26 |
-194.57 |
4.64 |
-9.22 |
0.29 |
0 |
|
|
365799 |
127318524 |
1 |
N3O4C20H35 |
A3B4C20D35 |
-199.11 |
1.03 |
-8.73 |
0.88 |
0 |
|
|
365800 |
127318525 |
1 |
N3O4C22H29 |
A3B4C22D29 |
-166.62 |
5.15 |
-9.08 |
-0.8 |
0 |
|
|
365801 |
127318526 |
1 |
N3O3C19H33 |
A3B3C19D33 |
-161.33 |
5.45 |
-9.1 |
0.96 |
0 |
|
|
365802 |
127318527 |
4 |
NOC5H8 |
ABC5D8 |
-172.54 |
4.6 |
-9.31 |
-0.16 |
0 |
|
|
365803 |
127318528 |
1 |
N3O4C14H23 |
A3B4C14D23 |
-198.13 |
2.59 |
-9.52 |
-0.28 |
0 |
|
|
365804 |
127318529 |
1 |
N3O4C17H27 |
A3B4C17D27 |
-173.22 |
4.9 |
-9.25 |
-0.1 |
0 |
|
|
365805 |
127318530 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-116.4 |
2.32 |
-8.97 |
0.18 |
0 |
|
|
365806 |
127318531 |
1 |
N2O3C19H26 |
A2B3C19D26 |
-109.63 |
4.02 |
-8.44 |
0.23 |
0 |
|
|
365807 |
127318532 |
1 |
N3O3C16H25 |
A3B3C16D25 |
-109.78 |
3.27 |
-9.21 |
0.58 |
0 |
|
|
365808 |
127318533 |
1 |
N2O3C16H28 |
A2B3C16D28 |
-146.72 |
2.81 |
-8.81 |
1.0 |
0 |
|
|
365809 |
127318534 |
1 |
SN3O5C16H23 |
AB3C5D16E23 |
-161.13 |
3.7 |
-9.34 |
-0.64 |
0 |
|
|
365810 |
127318535 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-137.35 |
4.56 |
-8.98 |
0.77 |
0 |
|
|
365811 |
127318542 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-52.79 |
6.2 |
-9.68 |
0.31 |
0 |
|
|
365812 |
127318543 |
1 |
O2N5C20H25 |
A2B5C20D25 |
-23.99 |
6.9 |
-8.68 |
-0.76 |
0 |
|
|
365813 |
127318544 |
1 |
N3O3C19H31 |
A3B3C19D31 |
-143.73 |
4.62 |
-9.02 |
0.73 |
0 |
|
|
365814 |
127318545 |
1 |
SN3O5C15H25 |
AB3C5D15E25 |
-199.7 |
2.58 |
-9.34 |
-0.38 |
0 |
|
|
365815 |
127318546 |
2 |
NO2C7H11 |
AB2C7D11 |
-178.96 |
2.34 |
-9.4 |
0.77 |
0 |
|
|
365816 |
127318547 |
1 |
O2N6C17H22 |
A2B6C17D22 |
5.33 |
5.92 |
-9.29 |
-0.9 |
0 |
|
|
365817 |
127318563 |
1 |
N2O3C21H30 |
A2B3C21D30 |
-114.22 |
4.52 |
-8.79 |
0.03 |
0 |
|
|
365818 |
127318564 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-6.88 |
2.12 |
-8.72 |
-1.13 |
0 |
|
|
365819 |
127318565 |
1 |
SO2N3C17H25 |
AB2C3D17E25 |
-60.33 |
2.73 |
-8.74 |
-0.47 |
0 |
|
|
365820 |
127318694 |
1 |
O2N4C23H24 |
A2B4C23D24 |
-6.19 |
6.69 |
-8.64 |
-0.55 |
0 |
|
|
365821 |
127318695 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-75.3 |
5.39 |
-8.26 |
0.11 |
0 |
|
|
365822 |
127318696 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-53.43 |
1.95 |
-8.74 |
-0.28 |
0 |
|
|
365823 |
127318697 |
1 |
SO3N4C18H24 |
AB3C4D18E24 |
-78.8 |
5.07 |
-9.39 |
-0.49 |
0 |
|
|
365824 |
127318698 |
1 |
SO3N4C17H22 |
AB3C4D17E22 |
-59.73 |
4.94 |
-9.35 |
-0.64 |
0 |
|
|
365825 |
127318699 |
1 |
OSN6C16H18 |
ABC6D16E18 |
70.4 |
4.21 |
-9.19 |
-1.06 |
0 |
|
|
365826 |
127318700 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-30.62 |
6.54 |
-8.26 |
0.07 |
0 |
|
|
365827 |
127318701 |
2 |
ON2C10H13 |
AB2C10D13 |
-23.79 |
4.34 |
-8.88 |
-0.16 |
0 |
|
|
365828 |
127318702 |
1 |
OSN4C19H20 |
ABC4D19E20 |
46.53 |
4.78 |
-9.42 |
-0.92 |
0 |
|
|
365829 |
127318703 |
1 |
OSN4C17H24 |
ABC4D17E24 |
-8.13 |
2.11 |
-9.24 |
-0.6 |
0 |
|
|
365830 |
127318704 |
1 |
O2N3C17H19 |
A2B3C17D19 |
-19.77 |
4.14 |
-9.38 |
-0.37 |
0 |
|
|
365831 |
127318771 |
1 |
ON3C10H15 |
AB3C10D15 |
-19.72 |
4.0 |
-9.36 |
0.59 |
0 |
|
|
365832 |
127318772 |
2 |
ON2C10H15 |
AB2C10D15 |
-82.73 |
3.96 |
-9.23 |
0.4 |
0 |
|
|
365833 |
127318773 |
1 |
O2N4C19H30 |
A2B4C19D30 |
-85.42 |
4.3 |
-9.3 |
0.54 |
0 |
|
|
365834 |
127318774 |
2 |
ON2C9H14 |
AB2C9D14 |
-83.58 |
3.29 |
-9.46 |
0.47 |
0 |
|
|
365835 |
127318775 |
1 |
ClON6C20H23 |
ABC6D20E23 |
51.49 |
5.48 |
-9.34 |
-0.92 |
0 |
|
|
365836 |
127318776 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-18.67 |
2.71 |
-9.51 |
-1.07 |
0 |
|
|
365837 |
127318777 |
2 |
ON2C9H14 |
AB2C9D14 |
-85.35 |
1.52 |
-9.24 |
0.61 |
0 |
|
|
365838 |
127318778 |
1 |
O2N6C17H24 |
A2B6C17D24 |
-12.18 |
3.52 |
-9.42 |
0.25 |
0 |
|
|
365839 |
127318779 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-63.47 |
3.56 |
-9.23 |
0.44 |
0 |
|
|
365840 |
127318780 |
1 |
ClON5C19H20 |
ABC5D19E20 |
44.85 |
2.65 |
-9.32 |
-0.84 |
0 |
|
|
365841 |
127318781 |
2 |
ON2C11H14 |
AB2C11D14 |
-40.58 |
7.11 |
-9.05 |
0.22 |
0 |