List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
135612 |
51901937 |
1 |
FSN5C15H17 |
ABC5D15E17 |
76.59 |
14.06 |
0.0 |
0.0 |
1 |
|
|
135613 |
51902148 |
1 |
ON3C22H34 |
AB3C22D34 |
-14.65 |
3.65 |
0.0 |
0.0 |
-1 |
|
|
135614 |
51902556 |
1 |
N5O7H22C24 |
A5B7C22D24 |
-73.53 |
6.77 |
0.0 |
0.0 |
1 |
|
|
135615 |
51902557 |
1 |
ON4C22H35 |
AB4C22D35 |
5.7 |
3.54 |
0.0 |
0.0 |
0 |
|
|
135616 |
51902558 |
1 |
ON4C22H34 |
AB4C22D34 |
-12.83 |
2.76 |
-8.58 |
0.5 |
0 |
|
|
135617 |
51902578 |
1 |
ClO3N4C17H17 |
AB3C4D17E17 |
-15.34 |
4.96 |
-9.14 |
-1.1 |
0 |
|
|
135618 |
51902703 |
2 |
N2C13H16 |
A2B13C16 |
63.66 |
5.57 |
-8.62 |
-1.04 |
0 |
|
|
135619 |
51903199 |
1 |
O2N3C24H39 |
A2B3C24D39 |
-83.8 |
5.51 |
-7.9 |
0.75 |
0 |
|
|
135620 |
51903506 |
1 |
ON3C22H25 |
AB3C22D25 |
18.9 |
6.77 |
-9.23 |
0.05 |
0 |
|
|
135621 |
51903979 |
1 |
BrSO2N3H16C19 |
ABC2D3E16F19 |
21.45 |
2.09 |
-8.63 |
-1.36 |
0 |
|
|
135622 |
51904401 |
1 |
N3O6H23C24 |
A3B6C23D24 |
-173.77 |
0.77 |
-9.67 |
-0.18 |
0 |
|
|
135623 |
51904402 |
1 |
N2O6H26C27 |
A2B6C26D27 |
-180.91 |
7.99 |
-8.08 |
-0.62 |
0 |
|
|
135624 |
51905231 |
1 |
FNO5H18C22 |
ABC5D18E22 |
-174.61 |
5.54 |
-8.97 |
-1.14 |
0 |
|
|
135625 |
51905413 |
1 |
OSN4C18H28 |
ABC4D18E28 |
2.44 |
6.03 |
-8.49 |
-0.38 |
1 |
|
|
135626 |
51905429 |
1 |
ON4C21H37 |
AB4C21D37 |
-16.04 |
2.19 |
0.0 |
0.0 |
1 |
|
|
135627 |
51906132 |
1 |
ON2C18H37 |
AB2C18D37 |
-63.56 |
1.44 |
0.0 |
0.0 |
0 |
|
|
135628 |
51906133 |
1 |
ON2C18H36 |
AB2C18D36 |
-93.74 |
1.92 |
-8.44 |
2.52 |
1 |
|
|
135629 |
51906134 |
1 |
ON4C23H35 |
AB4C23D35 |
21.58 |
4.75 |
0.0 |
0.0 |
1 |
|
|
135630 |
51906656 |
1 |
ClFON3C22H28 |
ABCD3E22F28 |
-45.3 |
5.78 |
0.0 |
0.0 |
1 |
|
|
135631 |
51906732 |
1 |
ClN3O3C22H31 |
AB3C3D22E31 |
-58.9 |
5.05 |
0.0 |
0.0 |
0 |
|
|
135632 |
51906808 |
2 |
NO2C11H13 |
AB2C11D13 |
-128.19 |
1.08 |
-8.78 |
-0.18 |
0 |
|
|
135633 |
51906809 |
1 |
F2N2O4C21H22 |
A2B2C4D21E22 |
-211.33 |
1.03 |
-8.8 |
-0.77 |
0 |
|
|
135634 |
51907019 |
1 |
N2S2O5C20H22 |
A2B2C5D20E22 |
-118.04 |
0.86 |
-8.94 |
-0.67 |
1 |
|
|
135635 |
51907378 |
1 |
FON4C19H28 |
ABC4D19E28 |
-16.01 |
2.25 |
0.0 |
0.0 |
1 |
|
|
135636 |
51907438 |
1 |
N3O3C25H34 |
A3B3C25D34 |
-58.24 |
3.54 |
0.0 |
0.0 |
0 |
|
|
135637 |
51907472 |
1 |
FN3O5C20H22 |
AB3C5D20E22 |
-180.96 |
6.21 |
-9.33 |
-0.42 |
0 |
|
|
135638 |
51907473 |
1 |
SN2O4C24H32 |
AB2C4D24E32 |
-146.16 |
5.7 |
-9.19 |
-0.36 |
0 |
|
|
135639 |
51907474 |
1 |
SN2O4C24H32 |
AB2C4D24E32 |
-147.55 |
9.7 |
-8.6 |
-0.7 |
0 |
|
|
135640 |
51907591 |
1 |
SN6C18H18 |
AB6C18D18 |
150.68 |
6.06 |
-9.14 |
-0.88 |
0 |
|
|
135641 |
51907883 |
1 |
INO3C13H14 |
ABC3D13E14 |
-76.06 |
2.34 |
-9.9 |
-1.32 |
0 |
|
|
135642 |
51907916 |
1 |
BrNO4C16H16 |
ABC4D16E16 |
-108.42 |
4.95 |
-9.41 |
-1.19 |
0 |
|
|
135643 |
51908564 |
1 |
ClSO3N4C22H27 |
ABC3D4E22F27 |
-54.18 |
3.62 |
-9.15 |
-0.68 |
0 |
|
|
135644 |
51908629 |
1 |
SN3O8C18H23 |
AB3C8D18E23 |
-251.64 |
9.02 |
-10.38 |
-1.82 |
0 |
|
|
135645 |
51908952 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-46.06 |
4.25 |
-8.43 |
0.51 |
0 |
|
|
135646 |
51908953 |
1 |
S2N3O5C20H25 |
A2B3C5D20E25 |
-177.0 |
2.46 |
-8.8 |
-0.4 |
0 |
|
|
135647 |
51908954 |
1 |
SN2O3C20H22 |
AB2C3D20E22 |
-87.11 |
6.41 |
-8.96 |
-0.61 |
0 |
|
|
135648 |
51909601 |
1 |
Cl2N2O7C22H24 |
A2B2C7D22E24 |
-296.31 |
6.89 |
-9.48 |
-0.99 |
0 |
|
|
135649 |
51909893 |
1 |
FO2N3C21H28 |
AB2C3D21E28 |
-88.02 |
0.74 |
-8.57 |
-0.05 |
1 |
|
|
135650 |
51909894 |
1 |
ClOSN3C21H27 |
ABCD3E21F27 |
16.14 |
2.53 |
0.0 |
0.0 |
1 |
|
|
135651 |
51909895 |
1 |
ON4C27H33 |
AB4C27D33 |
38.66 |
6.59 |
0.0 |
0.0 |
0 |
|
|
135652 |
51910279 |
1 |
F3O3N4C22H25 |
A3B3C4D22E25 |
-207.59 |
7.24 |
-8.14 |
-0.58 |
0 |
|
|
135653 |
51910346 |
1 |
SO2N4C19H22 |
AB2C4D19E22 |
-6.81 |
2.54 |
-9.01 |
-1.1 |
0 |
|
|
135654 |
51910347 |
1 |
SO2N4C19H22 |
AB2C4D19E22 |
-4.7 |
7.06 |
-9.04 |
-1.14 |
0 |
|
|
135655 |
51911157 |
1 |
FOSN5C21H32 |
ABCD5E21F32 |
-54.65 |
3.84 |
-9.01 |
-0.52 |
1 |
|
|
135656 |
51911180 |
1 |
ClSO2N5C20H31 |
ABC2D5E20F31 |
-24.41 |
6.84 |
0.0 |
0.0 |
0 |
|
|
135657 |
51911570 |
1 |
SN2O5C22H26 |
AB2C5D22E26 |
-166.61 |
2.77 |
-9.88 |
-1.59 |
0 |
|
|
135658 |
51911669 |
2 |
N2O2C11H11 |
A2B2C11D11 |
-83.51 |
6.05 |
-9.03 |
-0.98 |
0 |
|
|
135659 |
51911706 |
1 |
N3O5C28H31 |
A3B5C28D31 |
-156.63 |
1.79 |
-8.14 |
-0.71 |
0 |
|
|
135660 |
51911832 |
1 |
Cl3N3O3H16C19 |
A3B3C3D16E19 |
-102.84 |
1.73 |
-9.71 |
-0.92 |
0 |
|
|
135661 |
51911967 |
1 |
NSO5C21H29 |
ABC5D21E29 |
-210.34 |
3.81 |
-9.68 |
-1.09 |
0 |
|
|
135662 |
51911996 |
1 |
Cl2O3N5H13C17 |
A2B3C5D13E17 |
-10.76 |
6.56 |
-9.15 |
-1.8 |
0 |
|
|
135663 |
51912176 |
1 |
OSN6C25H32 |
ABC6D25E32 |
43.74 |
6.62 |
-7.85 |
-0.35 |
0 |
|
|
135664 |
51912200 |
1 |
OSN6C27H34 |
ABC6D27E34 |
42.95 |
7.62 |
-7.79 |
-0.53 |
0 |
|
|
135665 |
51912819 |
1 |
FSN2O5C25H25 |
ABC2D5E25F25 |
-192.04 |
7.43 |
-8.66 |
-0.92 |
0 |
|
|
135666 |
51912820 |
1 |
FSN2O5C25H25 |
ABC2D5E25F25 |
-195.07 |
7.49 |
-8.44 |
-1.09 |
0 |
|
|
135667 |
51912821 |
1 |
FSN2O5C26H27 |
ABC2D5E26F27 |
-201.9 |
6.65 |
-8.75 |
-1.08 |
0 |
|
|
135668 |
51912864 |
1 |
NSO7C16H19 |
ABC7D16E19 |
-254.23 |
6.63 |
-9.18 |
-0.58 |
0 |
|
|
135669 |
51912865 |
1 |
NSO7C19H25 |
ABC7D19E25 |
-263.31 |
5.4 |
-9.2 |
-0.58 |
0 |
|
|
135670 |
51912866 |
1 |
NSO7C19H25 |
ABC7D19E25 |
-268.68 |
6.62 |
-9.1 |
-0.49 |
0 |
|
|
135671 |
51913009 |
1 |
OSN6C20H26 |
ABC6D20E26 |
52.06 |
9.56 |
-9.25 |
-0.72 |
0 |
|
|
135672 |
51913010 |
1 |
OSN5C21H25 |
ABC5D21E25 |
42.31 |
5.29 |
-8.35 |
-0.58 |
0 |
|
|
135673 |
51913463 |
1 |
SN3O5C24H29 |
AB3C5D24E29 |
-181.19 |
3.82 |
-8.95 |
-0.99 |
0 |
|
|
135674 |
51913822 |
1 |
BrNSO6H18C20 |
ABCD6E18F20 |
-162.2 |
7.27 |
-9.52 |
-0.68 |
0 |
|
|
135675 |
51913823 |
1 |
BrNSO6H18C20 |
ABCD6E18F20 |
-158.68 |
8.94 |
-9.48 |
-0.76 |
0 |
|
|
135676 |
51913824 |
1 |
BrNO5C14H18 |
ABC5D14E18 |
-183.26 |
1.33 |
-9.52 |
-0.45 |
0 |
|
|
135677 |
51913979 |
1 |
BrN3O5H18C20 |
AB3C5D18E20 |
-144.02 |
2.23 |
-9.66 |
-1.69 |
0 |
|
|
135678 |
51914026 |
1 |
NO6C25H25 |
AB6C25D25 |
-173.21 |
8.34 |
-8.52 |
-0.62 |
0 |
|
|
135679 |
51914027 |
1 |
NO6C25H25 |
AB6C25D25 |
-170.71 |
6.88 |
-8.34 |
-0.46 |
0 |
|
|
135680 |
51914028 |
1 |
NO5C21H25 |
AB5C21D25 |
-179.66 |
3.06 |
-9.23 |
-0.87 |
1 |
|
|
135681 |
51914285 |
1 |
N2O7C20H21 |
A2B7C20D21 |
-180.58 |
5.76 |
0.0 |
0.0 |
0 |
|
|
135682 |
51914926 |
1 |
SN2O5C20H20 |
AB2C5D20E20 |
-133.96 |
8.18 |
-8.69 |
-0.6 |
0 |
|
|
135683 |
51915254 |
2 |
NO3C12H15 |
AB3C12D15 |
-213.84 |
2.77 |
-8.7 |
-0.32 |
0 |
|
|
135684 |
51915575 |
1 |
SN2O6C25H32 |
AB2C6D25E32 |
-219.34 |
3.61 |
-8.69 |
-1.27 |
0 |
|
|
135685 |
51915612 |
1 |
SN2O5C24H30 |
AB2C5D24E30 |
-190.3 |
6.51 |
-8.62 |
-1.33 |
0 |
|
|
135686 |
51915784 |
1 |
SN2O5C24H28 |
AB2C5D24E28 |
-168.55 |
8.38 |
-8.43 |
-1.0 |
0 |
|
|
135687 |
51915836 |
1 |
ClN2O7H17C24 |
AB2C7D17E24 |
-109.33 |
9.08 |
-9.14 |
-1.53 |
0 |
|
|
135688 |
51916759 |
1 |
SN3O5C21H23 |
AB3C5D21E23 |
-180.23 |
2.85 |
-8.71 |
-0.86 |
0 |
|
|
135689 |
51917315 |
1 |
FNO5H22C25 |
ABC5D22E25 |
-153.67 |
5.71 |
-8.98 |
-0.97 |
0 |
|
|
135690 |
51917316 |
1 |
FNO5H22C25 |
ABC5D22E25 |
-154.85 |
6.64 |
-8.7 |
-0.91 |
0 |
|
|
135691 |
51917317 |
1 |
SN2O6H22C24 |
AB2C6D22E24 |
-101.67 |
4.25 |
-8.64 |
-0.97 |
0 |
|
|
135692 |
51917354 |
1 |
FN2O7H19C20 |
AB2C7D19E20 |
-192.98 |
10.87 |
-8.93 |
-1.36 |
0 |
|
|
135693 |
51917735 |
1 |
N2O7C25H26 |
A2B7C25D26 |
-187.04 |
9.92 |
-8.91 |
-1.0 |
0 |
|
|
135694 |
51918139 |
2 |
NO2C14H17 |
AB2C14D17 |
-173.62 |
3.14 |
-8.41 |
0.08 |
0 |
|
|
135695 |
51918140 |
2 |
NO2C14H17 |
AB2C14D17 |
-171.26 |
7.07 |
-8.58 |
0.05 |
0 |
|
|
135696 |
51918141 |
2 |
NO2C14H17 |
AB2C14D17 |
-172.42 |
3.55 |
-8.72 |
0.02 |
0 |
|
|
135697 |
51918417 |
1 |
N2O5C25H36 |
A2B5C25D36 |
-235.25 |
6.52 |
-8.84 |
0.13 |
0 |
|
|
135698 |
51919028 |
1 |
SN2O6C21H26 |
AB2C6D21E26 |
-238.36 |
4.83 |
-9.18 |
-0.14 |
0 |
|
|
135699 |
51919801 |
1 |
SN2O5C22H26 |
AB2C5D22E26 |
-179.33 |
10.07 |
-8.11 |
-0.87 |
0 |
|
|
135700 |
51920006 |
1 |
SN3O5H17C20 |
AB3C5D17E20 |
-115.43 |
4.98 |
-9.37 |
-1.63 |
0 |
|
|
135701 |
51920007 |
1 |
SN3O5H17C20 |
AB3C5D17E20 |
-114.63 |
9.74 |
-9.42 |
-1.73 |
0 |
|
|
135702 |
51920014 |
1 |
N2O6C25H30 |
A2B6C25D30 |
-217.91 |
7.01 |
-8.8 |
-1.06 |
0 |
|
|
135703 |
51920035 |
1 |
N2O6H22C23 |
A2B6C22D23 |
-195.93 |
9.44 |
-9.3 |
-1.4 |
0 |
|
|
135704 |
51920415 |
1 |
N2O5C24H30 |
A2B5C24D30 |
-171.56 |
6.39 |
-8.79 |
-0.07 |
0 |
|
|
135705 |
51920591 |
1 |
N2O5C23H26 |
A2B5C23D26 |
-173.37 |
7.79 |
-8.65 |
-0.46 |
0 |
|
|
135706 |
51920597 |
1 |
ClN2F3O5C22H22 |
AB2C3D5E22F22 |
-344.52 |
5.97 |
-9.35 |
-0.96 |
0 |
|
|
135707 |
51920598 |
1 |
ClN2O5C22H25 |
AB2C5D22E25 |
-194.74 |
4.5 |
-8.87 |
-0.42 |
0 |
|
|
135708 |
51920599 |
1 |
ClN2O5C22H25 |
AB2C5D22E25 |
-192.79 |
3.8 |
-8.71 |
-0.29 |
0 |
|
|
135709 |
51920629 |
1 |
N2O7C23H26 |
A2B7C23D26 |
-257.96 |
3.67 |
-9.21 |
-0.72 |
0 |
|
|
135710 |
51920663 |
1 |
FSN2O4C23H23 |
ABC2D4E23F23 |
-146.28 |
3.57 |
-9.23 |
-1.12 |
0 |
|
|
135711 |
51920664 |
1 |
SN2O5C24H26 |
AB2C5D24E26 |
-141.08 |
4.86 |
-8.85 |
-0.78 |
0 |