List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
431594 |
135171682 |
1 |
O2N3H31C55 |
A2B3C31D55 |
217.45 |
3.32 |
-8.28 |
-1.04 |
0 |
|
|
431595 |
135171683 |
2 |
NOH14C24 |
ABC14D24 |
170.59 |
1.69 |
-7.95 |
-1.14 |
0 |
|
|
431596 |
135171684 |
1 |
N2O2H30C49 |
A2B2C30D49 |
154.58 |
2.15 |
-8.24 |
-0.96 |
0 |
|
|
431597 |
135171685 |
1 |
NPO8C22H30 |
ABC8D22E30 |
-403.8 |
4.94 |
-8.9 |
-0.63 |
0 |
|
|
431598 |
135171686 |
1 |
O3N5C25H33 |
A3B5C25D33 |
-52.95 |
7.25 |
-8.91 |
-1.22 |
0 |
|
|
431599 |
135171687 |
1 |
N2O3H34C60 |
A2B3C34D60 |
187.86 |
5.44 |
-8.14 |
-1.31 |
0 |
|
|
431600 |
135171688 |
2 |
NOH16C27 |
ABC16D27 |
185.21 |
1.76 |
-8.2 |
-1.23 |
0 |
|
|
431601 |
135171689 |
2 |
NOH18C30 |
ABC18D30 |
209.4 |
2.12 |
-8.08 |
-0.97 |
0 |
|
|
431602 |
135171690 |
2 |
NOH17C29 |
ABC17D29 |
201.96 |
0.6 |
-8.0 |
-1.17 |
0 |
|
|
431603 |
135171691 |
1 |
NPO7C27H34 |
ABC7D27E34 |
-326.62 |
8.84 |
-8.6 |
-0.5 |
0 |
|
|
431604 |
135171692 |
1 |
NP2O10C25H41 |
AB2C10D25E41 |
-560.61 |
2.36 |
-8.66 |
-0.36 |
0 |
|
|
431605 |
135171693 |
1 |
NPO7C20H28 |
ABC7D20E28 |
-361.07 |
2.63 |
-8.51 |
-0.62 |
0 |
|
|
431606 |
135171694 |
1 |
SF3O3N4C25H35 |
AB3C3D4E25F35 |
-252.15 |
7.0 |
-8.66 |
-1.08 |
0 |
|
|
431608 |
135171696 |
1 |
SO2F3N4C24H33 |
AB2C3D4E24F33 |
-208.74 |
6.27 |
-8.3 |
-1.02 |
0 |
|
|
431609 |
135171697 |
1 |
ClO3N4C13H17 |
AB3C4D13E17 |
-38.2 |
4.25 |
-9.67 |
-0.9 |
0 |
|
|
431610 |
135171698 |
2 |
NO2C10H15 |
AB2C10D15 |
-99.12 |
6.82 |
-8.72 |
-1.0 |
0 |
|
|
431611 |
135171699 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-29.83 |
2.66 |
-8.79 |
-1.16 |
0 |
|
|
431612 |
135171700 |
1 |
N2H44C61 |
A2B44C61 |
267.17 |
2.77 |
-7.99 |
-0.53 |
0 |
|
|
431613 |
135171701 |
1 |
OC17H18 |
AB17C18 |
21.89 |
5.15 |
-8.57 |
-0.74 |
0 |
|
|
431614 |
135171702 |
1 |
ClOH9C20 |
ABC9D20 |
264.77 |
13.44 |
-7.56 |
-3.28 |
0 |
|
|
431615 |
135171703 |
1 |
F3N3O3C26H34 |
A3B3C3D26E34 |
-265.74 |
6.62 |
-8.64 |
-0.84 |
0 |
|
|
431616 |
135171704 |
1 |
NOC11H23 |
ABC11D23 |
-72.69 |
3.08 |
-8.47 |
2.65 |
0 |
|
|
431617 |
135171705 |
1 |
F3N5O6C46H64 |
A3B5C6D46E64 |
-408.89 |
7.95 |
-8.33 |
-0.82 |
0 |
|
|
431618 |
135171706 |
1 |
SO2F3N4C23H33 |
AB2C3D4E23F33 |
-219.31 |
7.12 |
-8.9 |
-1.14 |
0 |
|
|
431619 |
135171707 |
2 |
NOC10H17 |
ABC10D17 |
-118.33 |
2.62 |
-8.11 |
0.39 |
0 |
|
|
431620 |
135171708 |
1 |
N2O3C22H36 |
A2B3C22D36 |
-152.01 |
3.21 |
-8.21 |
0.37 |
0 |
|
|
431621 |
135171717 |
1 |
N3O6C25H39 |
A3B6C25D39 |
-217.15 |
7.8 |
-9.11 |
-0.85 |
0 |
|
|
431622 |
135171718 |
2 |
NO2C11H17 |
AB2C11D17 |
-122.15 |
3.78 |
-8.88 |
-0.62 |
0 |
|
|
431623 |
135171719 |
1 |
O8N11C31H41 |
A8B11C31D41 |
-198.74 |
8.28 |
-9.16 |
-1.61 |
0 |
|
|
431624 |
135171720 |
1 |
SN3O5C21H33 |
AB3C5D21E33 |
-130.87 |
2.68 |
-8.41 |
-0.57 |
0 |
|
|
431625 |
135171721 |
2 |
NC7H15 |
AB7C15 |
-49.64 |
3.15 |
-8.18 |
2.65 |
0 |
|
|
431626 |
135171722 |
2 |
NC7H15 |
AB7C15 |
-41.69 |
1.57 |
-8.45 |
2.71 |
0 |
|
|
431627 |
135171723 |
1 |
O8N11C32H43 |
A8B11C32D43 |
-201.48 |
5.05 |
-9.03 |
-1.45 |
0 |
|
|
431628 |
135171724 |
2 |
NC10H20 |
AB10C20 |
-49.47 |
0.44 |
-8.35 |
1.31 |
0 |
|
|
431629 |
135171725 |
1 |
O3N4C27H36 |
A3B4C27D36 |
-81.76 |
10.77 |
-8.78 |
-0.82 |
0 |
|
|
431630 |
135171726 |
1 |
NO3C26H47 |
AB3C26D47 |
-209.09 |
6.04 |
-9.51 |
0.48 |
0 |
|
|
431631 |
135171727 |
1 |
F3O3N5C26H40 |
A3B3C5D26E40 |
-243.82 |
3.86 |
-8.24 |
-0.38 |
0 |
|
|
431632 |
135171728 |
1 |
N3O4C22H35 |
A3B4C22D35 |
-190.05 |
2.12 |
-8.43 |
0.18 |
0 |
|
|
431633 |
135171729 |
1 |
SF3O4N5C25H34 |
AB3C4D5E25F34 |
-293.14 |
6.28 |
-8.98 |
-1.23 |
0 |
|
|
431634 |
135171730 |
1 |
SF3O4N5C24H32 |
AB3C4D5E24F32 |
-288.25 |
12.42 |
-9.16 |
-1.27 |
0 |
|
|
431635 |
135171731 |
1 |
SO2F3N4C21H27 |
AB2C3D4E21F27 |
-182.5 |
6.86 |
-9.08 |
-1.32 |
0 |
|
|
431636 |
135171732 |
1 |
SN3O3C25H35 |
AB3C3D25E35 |
-89.86 |
6.23 |
-8.43 |
-0.5 |
0 |
|
|
431637 |
135171733 |
1 |
NO4C15H27 |
AB4C15D27 |
-205.75 |
1.08 |
-9.9 |
0.45 |
0 |
|
|
431638 |
135171734 |
1 |
O3N5C24H37 |
A3B5C24D37 |
-103.42 |
5.46 |
-8.44 |
-0.12 |
0 |
|
|
431639 |
135171735 |
1 |
O3N5C24H35 |
A3B5C24D35 |
-66.45 |
5.73 |
-8.6 |
-0.12 |
0 |
|
|
431640 |
135171736 |
1 |
NO5C23H31 |
AB5C23D31 |
-191.02 |
5.85 |
-9.82 |
-0.79 |
0 |
|
|
431641 |
135171737 |
1 |
N3O3C25H41 |
A3B3C25D41 |
-166.61 |
3.44 |
-8.29 |
0.21 |
0 |
|
|
431642 |
135171738 |
1 |
N3O3C25H41 |
A3B3C25D41 |
-168.06 |
3.69 |
-8.29 |
0.25 |
0 |
|
|
431643 |
135171739 |
1 |
N3O4C24H39 |
A3B4C24D39 |
-192.34 |
3.52 |
-8.36 |
0.28 |
0 |
|
|
431644 |
135171740 |
1 |
N3O4C24H39 |
A3B4C24D39 |
-191.37 |
5.48 |
-8.15 |
0.37 |
0 |
|
|
431645 |
135171741 |
1 |
SF3O3N5C26H34 |
AB3C3D5E26F34 |
-225.36 |
3.3 |
-9.27 |
-1.4 |
0 |
|
|
431646 |
135171742 |
1 |
N3O4C25H41 |
A3B4C25D41 |
-214.31 |
4.04 |
-8.29 |
0.35 |
0 |
|
|
431647 |
135171743 |
1 |
NO2C12H25 |
AB2C12D25 |
-115.83 |
1.28 |
-8.72 |
2.15 |
0 |
|
|
431648 |
135171744 |
1 |
OF3N3C8H10 |
AB3C3D8E10 |
-161.42 |
8.51 |
-9.56 |
-1.06 |
0 |
|
|
431649 |
135171745 |
1 |
N2O3C21H34 |
A2B3C21D34 |
-71.49 |
5.76 |
-8.43 |
-0.72 |
0 |
|
|
431650 |
135171746 |
1 |
SF3O4N5C28H40 |
AB3C4D5E28F40 |
-318.04 |
6.68 |
-9.0 |
-1.2 |
0 |
|
|
431651 |
135171747 |
1 |
ClFON2H16C18 |
ABCD2E16F18 |
-27.04 |
4.2 |
-8.86 |
-0.31 |
0 |
|
|
431652 |
135171748 |
1 |
ClFN2O3C23H26 |
ABC2D3E23F26 |
-175.99 |
5.19 |
-8.82 |
-0.25 |
0 |
|
|
431653 |
135171749 |
1 |
SN3O4C21H35 |
AB3C4D21E35 |
-188.22 |
5.23 |
-8.29 |
0.25 |
0 |
|
|
431654 |
135171750 |
1 |
NC17H19 |
AB17C19 |
86.3 |
1.66 |
-8.61 |
-0.44 |
0 |
|
|
431655 |
135171751 |
1 |
N2O2C23H36 |
A2B2C23D36 |
-100.14 |
2.55 |
-8.12 |
0.34 |
0 |
|
|
431656 |
135171752 |
2 |
ON2C14H19 |
AB2C14D19 |
-54.9 |
7.6 |
-8.52 |
-0.87 |
0 |
|
|
431657 |
135171753 |
1 |
NC10H13 |
AB10C13 |
19.02 |
1.58 |
-8.44 |
0.48 |
0 |
|
|
431658 |
135171754 |
1 |
ClSO2N4H17C18 |
ABC2D4E17F18 |
26.58 |
6.97 |
-8.65 |
-0.9 |
0 |
|
|
431659 |
135171755 |
1 |
N2O3C21H34 |
A2B3C21D34 |
-159.42 |
3.71 |
-8.32 |
0.22 |
0 |
|
|
431660 |
135171756 |
1 |
ClSO2N5H16C17 |
ABC2D5E16F17 |
30.5 |
4.69 |
-8.56 |
-0.87 |
0 |
|
|
431661 |
135171757 |
1 |
SF3O3N4C27H31 |
AB3C3D4E27F31 |
-201.7 |
6.0 |
-8.4 |
-1.23 |
0 |
|
|
431662 |
135171758 |
1 |
SF3O4N5C25H34 |
AB3C4D5E25F34 |
-286.22 |
4.8 |
-9.23 |
-1.42 |
0 |
|
|
431663 |
135171759 |
1 |
SF3O4N5C25H34 |
AB3C4D5E25F34 |
-285.55 |
5.29 |
-9.18 |
-1.41 |
0 |
|
|
431664 |
135171760 |
1 |
PO7N8C31H35 |
AB7C8D31E35 |
-188.07 |
8.21 |
-8.85 |
-1.05 |
0 |
|
|
431665 |
135171761 |
1 |
SO2F3N4C25H35 |
AB2C3D4E25F35 |
-212.71 |
6.8 |
-8.8 |
-1.08 |
0 |
|
|
431666 |
135171762 |
1 |
SO2F3N4C25H35 |
AB2C3D4E25F35 |
-218.06 |
7.75 |
-8.94 |
-0.98 |
0 |
|
|
431667 |
135171763 |
1 |
PSN5O7C33H40 |
ABC5D7E33F40 |
-215.21 |
10.66 |
-7.56 |
-0.49 |
0 |
|
|
431668 |
135171764 |
1 |
O3N5C25H33 |
A3B5C25D33 |
-59.32 |
9.65 |
-8.86 |
-1.23 |
0 |
|
|
431669 |
135171765 |
1 |
O3N5C25H33 |
A3B5C25D33 |
-53.77 |
10.44 |
-8.72 |
-1.12 |
0 |
|
|
431670 |
135171766 |
1 |
ClSN3O3C18H20 |
ABC3D3E18F20 |
-66.3 |
1.4 |
-8.48 |
-0.66 |
0 |
|
|
431671 |
135171767 |
1 |
O2F3N3C28H38 |
A2B3C3D28E38 |
-247.85 |
6.51 |
-8.59 |
-0.7 |
0 |
|
|
431672 |
135171768 |
1 |
BrO2F3N5C23H31 |
AB2C3D5E23F31 |
-207.63 |
5.09 |
-8.78 |
-0.77 |
0 |
|
|
431673 |
135171769 |
1 |
SN2O3C21H30 |
AB2C3D21E30 |
-104.3 |
4.93 |
-8.82 |
-0.76 |
0 |
|
|
431674 |
135171770 |
1 |
O2F3N4C22H31 |
A2B3C4D22E31 |
-232.1 |
6.08 |
-8.83 |
-0.51 |
0 |
|
|
431675 |
135171771 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-121.38 |
3.93 |
-8.76 |
-0.71 |
0 |
|
|
431676 |
135171772 |
1 |
N3O4C28H29 |
A3B4C28D29 |
-89.66 |
6.16 |
-8.88 |
-0.76 |
0 |
|
|
431677 |
135171773 |
1 |
O5C23H26 |
A5B23C26 |
-202.28 |
4.01 |
-8.84 |
-0.39 |
0 |
|
|
431678 |
135171774 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-164.2 |
4.35 |
-8.92 |
-0.78 |
0 |
|
|
431679 |
135171775 |
1 |
SO2F3N4C23H33 |
AB2C3D4E23F33 |
-222.4 |
8.54 |
-8.88 |
-1.38 |
0 |
|
|
431680 |
135171776 |
1 |
PN2O7C28H37 |
AB2C7D28E37 |
-317.74 |
7.02 |
-8.06 |
-0.4 |
0 |
|
|
431681 |
135171777 |
1 |
N3O5H23C24 |
A3B5C23D24 |
-99.55 |
5.9 |
-8.92 |
-1.12 |
0 |
|
|
431682 |
135171778 |
1 |
BrF2O2H15C20 |
AB2C2D15E20 |
-95.37 |
4.93 |
-8.8 |
-0.52 |
0 |
|
|
431683 |
135171779 |
1 |
PN3O6C27H32 |
AB3C6D27E32 |
-182.0 |
8.09 |
-8.62 |
-1.04 |
0 |
|
|
431684 |
135171780 |
1 |
N2O3C19H32 |
A2B3C19D32 |
-147.61 |
2.08 |
-8.21 |
0.22 |
0 |
|
|
431685 |
135171781 |
1 |
PN4O8C26H33 |
AB4C8D26E33 |
-343.34 |
5.46 |
-8.65 |
-1.31 |
0 |
|
|
431686 |
135171782 |
1 |
NP2O10C25H39 |
AB2C10D25E39 |
-546.25 |
4.51 |
-9.1 |
-0.82 |
0 |
|
|
431687 |
135171783 |
1 |
BrF2O2H11C18 |
AB2C2D11E18 |
-105.3 |
4.75 |
-9.15 |
-0.77 |
0 |
|
|
431688 |
135171784 |
1 |
N3O4H21C22 |
A3B4C21D22 |
-57.57 |
6.47 |
-8.86 |
-1.15 |
0 |
|
|
431689 |
135171785 |
1 |
O2S2F6N7C26H31 |
A2B2C6D7E26F31 |
-305.54 |
7.51 |
-9.17 |
-1.34 |
0 |
|
|
431690 |
135171786 |
2 |
ON3C10H17 |
AB3C10D17 |
18.09 |
4.88 |
-8.79 |
-0.64 |
0 |
|
|
431691 |
135171787 |
1 |
PN3O7C27H32 |
AB3C7D27E32 |
-249.75 |
5.82 |
-8.72 |
-1.1 |
0 |
|
|
431692 |
135171788 |
1 |
N2O3C19H32 |
A2B3C19D32 |
-145.91 |
2.76 |
-8.18 |
0.35 |
0 |
|
|
431693 |
135171789 |
1 |
SO2F3N4C23H33 |
AB2C3D4E23F33 |
-222.96 |
8.65 |
-8.85 |
-1.11 |
0 |
|
|
431694 |
135171790 |
2 |
NOC10H17 |
ABC10D17 |
-122.58 |
2.73 |
-8.09 |
0.37 |
0 |