List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
151789 |
56310591 |
1 |
ClN2O2C21H25 |
AB2C2D21E25 |
-33.54 |
6.72 |
-8.53 |
-0.16 |
0 |
|
|
151790 |
56310592 |
1 |
N3O3C21H25 |
A3B3C21D25 |
5.53 |
8.44 |
-9.09 |
-1.27 |
0 |
|
|
151791 |
56310593 |
1 |
O3N5C22H31 |
A3B5C22D31 |
-80.99 |
3.71 |
-8.67 |
-0.1 |
0 |
|
|
151792 |
56310594 |
1 |
N3O5C22H27 |
A3B5C22D27 |
-93.2 |
6.49 |
-8.65 |
-1.18 |
0 |
|
|
151793 |
56310599 |
1 |
ClO3N4C23H25 |
AB3C4D23E25 |
-40.61 |
5.61 |
-8.56 |
-1.1 |
0 |
|
|
151794 |
56310600 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-29.26 |
2.79 |
-8.68 |
-0.69 |
0 |
|
|
151795 |
56310601 |
1 |
ClN3O3C24H30 |
AB3C3D24E30 |
-109.45 |
6.42 |
-8.74 |
-0.26 |
0 |
|
|
151796 |
56310602 |
1 |
N3O3C24H31 |
A3B3C24D31 |
-101.28 |
4.17 |
-8.67 |
-0.14 |
0 |
|
|
151797 |
56310603 |
1 |
N3O4C24H31 |
A3B4C24D31 |
-133.68 |
5.68 |
-8.55 |
-0.09 |
0 |
|
|
151798 |
56310604 |
1 |
N3O4C23H29 |
A3B4C23D29 |
-134.3 |
3.6 |
-8.76 |
-0.39 |
0 |
|
|
151799 |
56310608 |
1 |
O2N6C25H26 |
A2B6C25D26 |
38.12 |
5.18 |
-9.4 |
-0.84 |
0 |
|
|
151800 |
56310609 |
1 |
OF3N6C22H23 |
AB3C6D22E23 |
-86.19 |
2.18 |
-9.4 |
-1.52 |
0 |
|
|
151801 |
56310610 |
1 |
O2N3C27H29 |
A2B3C27D29 |
-21.67 |
3.89 |
-8.93 |
-0.5 |
0 |
|
|
151802 |
56310611 |
1 |
N2O3C23H30 |
A2B3C23D30 |
-86.17 |
4.21 |
-8.88 |
0.2 |
0 |
|
|
151803 |
56310612 |
1 |
FN2O2C21H25 |
AB2C2D21E25 |
-96.86 |
2.66 |
-8.96 |
-0.08 |
0 |
|
|
151804 |
56310613 |
1 |
O2N4C27H36 |
A2B4C27D36 |
-39.75 |
3.53 |
-8.97 |
0.0 |
0 |
|
|
151805 |
56310614 |
2 |
ON2C13H17 |
AB2C13D17 |
-60.61 |
2.93 |
-7.85 |
0.19 |
0 |
|
|
151806 |
56310616 |
1 |
O3N4C24H28 |
A3B4C24D28 |
-20.2 |
5.06 |
-9.02 |
-0.43 |
0 |
|
|
151807 |
56310617 |
1 |
SO2N4C24H28 |
AB2C4D24E28 |
-28.46 |
1.92 |
-8.71 |
-0.73 |
0 |
|
|
151808 |
56310618 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-100.58 |
4.2 |
-8.87 |
-0.62 |
0 |
|
|
151809 |
56310619 |
1 |
N4O5C24H30 |
A4B5C24D30 |
-142.74 |
7.02 |
-8.81 |
-0.5 |
0 |
|
|
151810 |
56310620 |
1 |
O2N5C27H35 |
A2B5C27D35 |
-48.74 |
6.2 |
-8.81 |
0.14 |
0 |
|
|
151811 |
56310621 |
1 |
F2N3O5C22H25 |
A2B3C5D22E25 |
-194.25 |
6.62 |
-9.13 |
-1.16 |
0 |
|
|
151812 |
56310622 |
1 |
ClO2N4C21H25 |
AB2C4D21E25 |
-49.33 |
2.29 |
-9.24 |
-0.73 |
0 |
|
|
151813 |
56310623 |
1 |
N3O4C26H31 |
A3B4C26D31 |
-134.29 |
1.57 |
-8.37 |
-0.1 |
0 |
|
|
151814 |
56310625 |
1 |
N3O4C25H33 |
A3B4C25D33 |
-132.16 |
7.16 |
-8.48 |
0.04 |
0 |
|
|
151815 |
56310626 |
1 |
ClN3O3C23H28 |
AB3C3D23E28 |
-101.08 |
3.01 |
-8.43 |
-0.21 |
0 |
|
|
151816 |
56310627 |
1 |
O3N4C24H38 |
A3B4C24D38 |
-133.96 |
4.07 |
-8.77 |
0.1 |
0 |
|
|
151817 |
56310628 |
1 |
ClO2N4C22H23 |
AB2C4D22E23 |
-27.86 |
5.16 |
-8.92 |
-1.3 |
0 |
|
|
151818 |
56310631 |
1 |
ClO2N4C22H23 |
AB2C4D22E23 |
15.31 |
5.64 |
-9.23 |
-0.97 |
0 |
|
|
151819 |
56310632 |
1 |
SN3O4C24H35 |
AB3C4D24E35 |
-171.73 |
6.7 |
-9.13 |
0.37 |
0 |
|
|
151820 |
56310633 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-58.34 |
4.63 |
-9.29 |
-1.28 |
0 |
|
|
151821 |
56310634 |
1 |
F2N3O3C22H25 |
A2B3C3D22E25 |
-195.21 |
2.07 |
-8.93 |
-0.44 |
0 |
|
|
151822 |
56310635 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-99.86 |
2.69 |
-9.04 |
0.26 |
0 |
|
|
151823 |
56310636 |
1 |
ClN3O3C22H26 |
AB3C3D22E26 |
-96.84 |
6.9 |
-8.61 |
-0.28 |
0 |
|
|
151824 |
56310637 |
1 |
O3N4C28H30 |
A3B4C28D30 |
-65.85 |
4.14 |
-9.0 |
-0.73 |
0 |
|
|
151825 |
56310638 |
1 |
SN4O4C22H28 |
AB4C4D22E28 |
-130.57 |
4.9 |
-9.33 |
-0.75 |
0 |
|
|
151826 |
56310639 |
1 |
O2N3C27H37 |
A2B3C27D37 |
-79.04 |
2.0 |
-8.98 |
0.25 |
0 |
|
|
151827 |
56310640 |
1 |
O2N3C23H29 |
A2B3C23D29 |
-67.48 |
3.89 |
-8.51 |
0.1 |
0 |
|
|
151828 |
56310641 |
1 |
O4N5C22H23 |
A4B5C22D23 |
7.94 |
3.64 |
-9.32 |
-2.07 |
0 |
|
|
151829 |
56310642 |
1 |
ClN2O3C22H25 |
AB2C3D22E25 |
-96.66 |
4.87 |
-8.74 |
-0.48 |
0 |
|
|
151830 |
56310643 |
1 |
N3O4C23H27 |
A3B4C23D27 |
-117.09 |
1.5 |
-8.46 |
-0.2 |
0 |
|
|
151831 |
56310644 |
1 |
O2N3C28H31 |
A2B3C28D31 |
-25.85 |
3.34 |
-8.92 |
-0.12 |
0 |
|
|
151832 |
56310645 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-58.37 |
10.05 |
-9.34 |
-1.29 |
0 |
|
|
151833 |
56310646 |
1 |
SO2N4C25H28 |
AB2C4D25E28 |
-19.74 |
2.69 |
-8.85 |
-0.69 |
0 |
|
|
151834 |
56310647 |
1 |
ClN4O4C21H23 |
AB4C4D21E23 |
-55.45 |
6.26 |
-9.35 |
-1.39 |
0 |
|
|
151835 |
56310649 |
1 |
FO2N4C20H29 |
AB2C4D20E29 |
-113.13 |
2.67 |
-8.88 |
0.08 |
0 |
|
|
151836 |
56310650 |
1 |
FON3C25H32 |
ABC3D25E32 |
-41.13 |
3.12 |
-8.83 |
0.05 |
0 |
|
|
151837 |
56310651 |
1 |
FON3C21H32 |
ABC3D21E32 |
-86.85 |
4.85 |
-8.53 |
0.25 |
0 |
|
|
151838 |
56310655 |
1 |
FO2N3C22H28 |
AB2C3D22E28 |
-81.53 |
3.23 |
-8.84 |
0.03 |
0 |