List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
130707 |
51093975 |
2 |
ON2C9H11 |
AB2C9D11 |
-17.45 |
4.63 |
-8.96 |
-0.88 |
0 |
|
|
130708 |
51094039 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-99.17 |
4.6 |
-8.47 |
0.09 |
0 |
|
|
130709 |
51094581 |
1 |
NO2F3C14H16 |
AB2C3D14E16 |
-211.19 |
4.25 |
-9.12 |
-0.3 |
0 |
|
|
130710 |
51094582 |
1 |
NF3O3C16H20 |
AB3C3D16E20 |
-262.11 |
7.29 |
-8.93 |
0.1 |
0 |
|
|
130711 |
51094618 |
1 |
SN3O3C15H21 |
AB3C3D15E21 |
-94.78 |
3.06 |
-9.08 |
-0.89 |
0 |
|
|
130712 |
51094934 |
1 |
O2N4C17H22 |
A2B4C17D22 |
9.55 |
7.19 |
-8.51 |
-0.38 |
0 |
|
|
130713 |
51095035 |
2 |
NOC9H13 |
ABC9D13 |
-75.61 |
4.2 |
-8.6 |
0.17 |
0 |
|
|
130714 |
51095288 |
1 |
SN2O6H12C15 |
AB2C6D12E15 |
-186.61 |
8.94 |
-9.75 |
-1.63 |
0 |
|
|
130715 |
51095783 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-225.46 |
4.44 |
-9.49 |
-0.48 |
0 |
|
|
130716 |
51095784 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-86.55 |
6.42 |
-9.39 |
-0.86 |
0 |
|
|
130717 |
51095837 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-92.03 |
4.07 |
-9.37 |
-0.52 |
0 |
|
|
130718 |
51095838 |
1 |
O2N3C19H19 |
A2B3C19D19 |
11.86 |
4.11 |
-9.27 |
-0.43 |
0 |
|
|
130719 |
51095839 |
1 |
ON7H15C18 |
AB7C15D18 |
139.91 |
9.46 |
-9.65 |
-1.32 |
0 |
|
|
130720 |
51095840 |
1 |
O2N3H19C20 |
A2B3C19D20 |
19.51 |
3.97 |
-9.32 |
-0.82 |
0 |
|
|
130721 |
51096052 |
2 |
ON2C9H14 |
AB2C9D14 |
-70.14 |
5.21 |
-9.58 |
0.76 |
0 |
|
|
130722 |
51096613 |
1 |
FN2O2C16H23 |
AB2C2D16E23 |
-117.35 |
7.05 |
-8.42 |
-0.12 |
0 |
|
|
130723 |
51096614 |
1 |
F2O2N3C18H19 |
A2B2C3D18E19 |
-126.77 |
5.6 |
-8.51 |
-0.63 |
0 |
|
|
130724 |
51096615 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-43.6 |
3.94 |
-8.9 |
-0.16 |
0 |
|
|
130725 |
51096616 |
1 |
O2N3C21H21 |
A2B3C21D21 |
-4.3 |
6.76 |
-8.62 |
-1.4 |
0 |
|
|
130726 |
51096617 |
1 |
O2N4C19H20 |
A2B4C19D20 |
-1.62 |
6.35 |
-8.59 |
-1.12 |
0 |
|
|
130727 |
51096855 |
1 |
ON4H18C20 |
AB4C18D20 |
82.62 |
4.58 |
-9.67 |
-1.36 |
0 |
|
|
130728 |
51096968 |
1 |
N2O3C14H14 |
A2B3C14D14 |
-33.65 |
4.12 |
-9.04 |
-0.2 |
0 |
|
|
130729 |
51096969 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-10.94 |
5.92 |
-8.79 |
0.15 |
0 |
|
|
130730 |
51097113 |
2 |
ON2C9H14 |
AB2C9D14 |
-84.01 |
3.93 |
-8.86 |
-0.78 |
0 |
|
|
130731 |
51097404 |
1 |
N2O4C17H20 |
A2B4C17D20 |
-129.7 |
5.51 |
-9.12 |
-0.85 |
0 |
|
|
130732 |
51097474 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-129.92 |
5.95 |
-9.56 |
-0.68 |
0 |
|
|
130733 |
51097475 |
1 |
ClN3O3C16H16 |
AB3C3D16E16 |
-89.78 |
2.51 |
-9.44 |
-0.6 |
0 |
|
|
130734 |
51097569 |
1 |
O2N5C16H17 |
A2B5C16D17 |
23.29 |
6.43 |
-9.29 |
-1.22 |
0 |
|
|
130735 |
51097886 |
1 |
NO4C20H27 |
AB4C20D27 |
-119.14 |
4.0 |
-8.58 |
0.04 |
0 |
|
|
130736 |
51098358 |
1 |
N3O4C17H23 |
A3B4C17D23 |
-138.7 |
4.56 |
-9.64 |
-0.03 |
0 |
|
|
130737 |
51098614 |
1 |
FN2O3C18H25 |
AB2C3D18E25 |
-178.65 |
4.2 |
-8.91 |
-0.12 |
0 |
|
|
130738 |
51098615 |
1 |
FO2N4C16H19 |
AB2C4D16E19 |
-73.88 |
6.28 |
-8.93 |
-0.26 |
0 |
|
|
130739 |
51098616 |
1 |
FN3O3C17H22 |
AB3C3D17E22 |
-112.61 |
4.0 |
-9.05 |
-0.32 |
0 |
|
|
130740 |
51098617 |
1 |
FN2O3C17H23 |
AB2C3D17E23 |
-155.89 |
4.84 |
-8.97 |
-0.16 |
0 |
|
|
130741 |
51098618 |
1 |
FNO3C18H20 |
ABC3D18E20 |
-129.0 |
4.62 |
-8.78 |
-0.36 |
0 |
|
|
130742 |
51098619 |
1 |
FN3O4C17H20 |
AB3C4D17E20 |
-208.85 |
1.02 |
-9.01 |
-0.62 |
0 |
|
|
130743 |
51098620 |
1 |
FN2O3C18H27 |
AB2C3D18E27 |
-189.22 |
3.94 |
-8.99 |
-0.21 |
0 |
|
|
130744 |
51098621 |
1 |
FN3O4H16C17 |
AB3C4D16E17 |
-148.15 |
5.18 |
-8.9 |
-1.36 |
0 |
|
|
130745 |
51098622 |
1 |
FN2O3H17C19 |
AB2C3D17E19 |
-106.63 |
4.9 |
-9.11 |
-1.01 |
0 |
|
|
130746 |
51099052 |
1 |
O2N3H19C20 |
A2B3C19D20 |
-16.09 |
6.41 |
-8.84 |
-0.78 |
0 |
|
|
130747 |
51099053 |
1 |
ClO2N3C16H20 |
AB2C3D16E20 |
-37.53 |
5.36 |
-9.79 |
-0.53 |
0 |
|
|
130748 |
51099390 |
1 |
SO3N4C15H20 |
AB3C4D15E20 |
-75.14 |
7.96 |
-9.02 |
-0.51 |
0 |
|
|
130749 |
51099428 |
1 |
SO2N3C16H25 |
AB2C3D16E25 |
-87.48 |
2.4 |
-8.79 |
0.0 |
0 |
|
|
130750 |
51099558 |
2 |
NOC8H9 |
ABC8D9 |
-7.95 |
6.81 |
-8.94 |
-0.36 |
0 |
|
|
130751 |
51099572 |
1 |
SN3O4C13H19 |
AB3C4D13E19 |
-164.55 |
2.95 |
-8.85 |
-0.07 |
0 |
|
|
130752 |
51099640 |
1 |
FNS2O4C14H14 |
ABC2D4E14F14 |
-165.95 |
3.47 |
-9.48 |
-1.04 |
0 |
|
|
130753 |
51099682 |
1 |
SN3O3C11H15 |
AB3C3D11E15 |
-13.51 |
5.17 |
-9.04 |
-1.51 |
0 |
|
|
130754 |
51099827 |
2 |
NOC9H13 |
ABC9D13 |
-90.5 |
2.94 |
-8.07 |
0.36 |
0 |
|
|
130755 |
51099828 |
1 |
OSN3C19H23 |
ABC3D19E23 |
0.29 |
5.53 |
-8.03 |
-0.36 |
0 |
|
|
130756 |
51100291 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-59.13 |
2.69 |
-8.02 |
-0.2 |
0 |
|
|
130757 |
51100292 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-1.22 |
4.22 |
-9.13 |
0.11 |
0 |
|
|
130758 |
51100293 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-125.91 |
3.49 |
-8.64 |
-0.95 |
0 |
|
|
130759 |
51101452 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-58.94 |
1.73 |
-8.88 |
-0.68 |
0 |
|
|
130760 |
51101453 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-117.16 |
4.26 |
-9.07 |
-0.64 |
0 |
|
|
130761 |
51101454 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-21.18 |
5.47 |
-9.61 |
-1.12 |
0 |
|
|
130762 |
51101966 |
1 |
ON6C19H20 |
AB6C19D20 |
49.78 |
7.3 |
-8.66 |
-0.91 |
0 |
|
|
130763 |
51101967 |
1 |
ON6C19H20 |
AB6C19D20 |
61.39 |
2.93 |
-9.03 |
-1.26 |
0 |
|
|
130764 |
51102191 |
1 |
Cl2N3O3C14H17 |
A2B3C3D14E17 |
-119.84 |
2.19 |
-9.19 |
-0.6 |
0 |
|
|
130765 |
51102378 |
1 |
BrO2N3H12C13 |
AB2C3D12E13 |
26.23 |
3.74 |
-9.8 |
-0.6 |
0 |
|
|
130766 |
51103424 |
1 |
O4N5H13C14 |
A4B5C13D14 |
-52.75 |
5.55 |
-10.46 |
-1.7 |
0 |
|
|
130767 |
51103665 |
1 |
ON5C19H27 |
AB5C19D27 |
4.99 |
4.64 |
-8.68 |
-0.47 |
0 |
|
|
130768 |
51103866 |
1 |
OF3N4C16H25 |
AB3C4D16E25 |
-193.0 |
4.34 |
-8.8 |
-0.42 |
0 |
|
|
130769 |
51104020 |
1 |
FN4C17H17 |
AB4C17D17 |
72.7 |
2.02 |
-9.32 |
-0.94 |
0 |
|
|
130770 |
51104495 |
1 |
SN4C16H18 |
AB4C16D18 |
82.94 |
2.41 |
-8.88 |
-0.53 |
0 |
|
|
130771 |
51104552 |
1 |
SO2N5C16H23 |
AB2C5D16E23 |
-24.72 |
3.87 |
-8.89 |
-0.31 |
0 |
|
|
130772 |
51104638 |
1 |
FO2N3C19H26 |
AB2C3D19E26 |
-83.69 |
3.11 |
-8.98 |
-0.08 |
0 |
|
|
130773 |
51105020 |
1 |
ON5C18H23 |
AB5C18D23 |
56.99 |
2.58 |
-9.05 |
-0.2 |
0 |
|
|
130774 |
51105021 |
1 |
N6C19H26 |
A6B19C26 |
91.82 |
7.6 |
-8.95 |
-0.17 |
0 |
|
|
130775 |
51105237 |
1 |
N3O4C18H25 |
A3B4C18D25 |
-92.56 |
2.44 |
-8.57 |
-0.16 |
0 |
|
|
130776 |
51105476 |
1 |
ON4C15H28 |
AB4C15D28 |
-41.81 |
2.28 |
-8.71 |
1.5 |
0 |
|
|
130777 |
51105907 |
1 |
ON5C20H23 |
AB5C20D23 |
33.18 |
5.9 |
-9.26 |
-0.67 |
0 |
|
|
130778 |
51106051 |
1 |
SN2F3O5C11H11 |
AB2C3D5E11F11 |
-331.54 |
10.78 |
-9.85 |
-0.87 |
0 |
|
|
130779 |
51106052 |
1 |
O2N5H15C17 |
A2B5C15D17 |
53.45 |
4.84 |
-9.24 |
-0.83 |
0 |
|
|
130780 |
51106119 |
1 |
SN3O5C15H15 |
AB3C5D15E15 |
-147.96 |
5.38 |
-8.91 |
-0.51 |
0 |
|
|
130781 |
51106713 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-64.54 |
7.93 |
-9.1 |
-0.48 |
0 |
|
|
130782 |
51107004 |
1 |
SN2F3O4C12H15 |
AB2C3D4E12F15 |
-287.65 |
8.19 |
-9.08 |
-1.0 |
0 |
|
|
130783 |
51107175 |
1 |
O2N3C19H25 |
A2B3C19D25 |
2.49 |
4.71 |
-9.35 |
-0.44 |
0 |
|
|
130784 |
51107555 |
1 |
OF2N4C14H16 |
AB2C4D14E16 |
-87.67 |
6.08 |
-9.4 |
-0.42 |
0 |
|
|
130785 |
51107627 |
1 |
OSN2C16H18 |
ABC2D16E18 |
25.48 |
3.96 |
-9.03 |
-0.76 |
0 |
|
|
130786 |
51107628 |
1 |
ON4C21H24 |
AB4C21D24 |
28.01 |
6.62 |
-9.32 |
-1.03 |
0 |
|
|
130787 |
51107782 |
1 |
ON4C17H22 |
AB4C17D22 |
11.23 |
6.59 |
-9.84 |
-0.31 |
0 |
|
|
130788 |
51107830 |
1 |
OF2N3H15C19 |
AB2C3D15E19 |
-51.0 |
2.96 |
-8.14 |
-0.85 |
0 |
|
|
130789 |
51107831 |
1 |
OSN4C13H16 |
ABC4D13E16 |
30.94 |
3.46 |
-8.82 |
-0.22 |
0 |
|
|
130790 |
51107832 |
2 |
FON3H6C7 |
ABC3D6E7 |
-60.22 |
3.11 |
-8.91 |
-0.84 |
0 |
|
|
130791 |
51107833 |
1 |
SO2N3H15C17 |
AB2C3D15E17 |
15.2 |
6.14 |
-8.52 |
-1.48 |
0 |
|
|
130792 |
51107834 |
1 |
ON3C16H19 |
AB3C16D19 |
2.94 |
3.63 |
-8.76 |
-0.16 |
0 |
|
|
130793 |
51107835 |
1 |
O2N5H15C16 |
A2B5C15D16 |
6.08 |
0.7 |
-9.1 |
-0.59 |
0 |
|
|
130794 |
51107836 |
1 |
O2N3H13C15 |
A2B3C13D15 |
-8.73 |
4.79 |
-8.47 |
-0.63 |
0 |
|
|
130795 |
51107837 |
1 |
O4N5C16H17 |
A4B5C16D17 |
-26.5 |
3.41 |
-8.95 |
-0.92 |
0 |
|
|
130796 |
51108142 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-82.63 |
2.2 |
-9.14 |
-0.33 |
0 |
|
|
130797 |
51108172 |
1 |
FON2C16H17 |
ABC2D16E17 |
-64.34 |
7.34 |
-8.74 |
-0.24 |
0 |
|
|
130798 |
51108420 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-81.05 |
3.12 |
-8.8 |
-0.15 |
0 |
|
|
130799 |
51108437 |
1 |
SF2O2N3H13C15 |
AB2C2D3E13F15 |
-119.17 |
4.99 |
-9.03 |
-0.88 |
0 |
|
|
130800 |
51109102 |
1 |
OSN3C10H13 |
ABC3D10E13 |
10.7 |
7.15 |
-9.5 |
-0.67 |
0 |
|
|
130801 |
51109103 |
1 |
N6C15H22 |
A6B15C22 |
74.16 |
4.16 |
-8.33 |
-0.27 |
0 |
|
|
130802 |
51109104 |
1 |
ON5C17H23 |
AB5C17D23 |
38.62 |
3.07 |
-8.44 |
-0.33 |
0 |
|
|
130803 |
51109395 |
1 |
Cl2N3O3H9C15 |
A2B3C3D9E15 |
26.69 |
6.27 |
-9.42 |
-1.66 |
0 |
|
|
130804 |
51109650 |
1 |
NSO5C18H21 |
ABC5D18E21 |
-146.95 |
7.75 |
-9.2 |
-0.55 |
0 |
|
|
130805 |
51109651 |
1 |
NSF3O4C14H16 |
ABC3D4E14F16 |
-288.88 |
5.85 |
-9.57 |
-1.23 |
0 |
|
|
130806 |
51110037 |
1 |
N2O3C25H34 |
A2B3C25D34 |
-152.87 |
3.05 |
-9.44 |
0.3 |
0 |