List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
419131 |
135107579 |
1 |
SN2O3C20H28 |
AB2C3D20E28 |
-129.89 |
5.93 |
-9.15 |
-0.42 |
0 |
|
|
419132 |
135107580 |
4 |
NC5H7 |
AB5C7 |
36.38 |
4.63 |
-8.89 |
0.02 |
0 |
|
|
419133 |
135107581 |
1 |
O3N6C14H22 |
A3B6C14D22 |
-71.58 |
4.69 |
-8.56 |
0.06 |
0 |
|
|
419134 |
135107582 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-97.11 |
1.0 |
-8.96 |
0.12 |
0 |
|
|
419135 |
135107583 |
2 |
ON2C10H11 |
AB2C10D11 |
41.53 |
2.7 |
-9.3 |
-0.69 |
0 |
|
|
419136 |
135107584 |
1 |
SN2O4C22H24 |
AB2C4D22E24 |
-131.48 |
8.26 |
-8.77 |
-0.48 |
0 |
|
|
419137 |
135107585 |
1 |
O5N6C30H38 |
A5B6C30D38 |
-173.19 |
6.97 |
-9.4 |
-0.66 |
0 |
|
|
419138 |
135107586 |
1 |
SN4O4C14H20 |
AB4C4D14E20 |
-113.68 |
4.84 |
-9.78 |
-0.42 |
0 |
|
|
419139 |
135107587 |
1 |
ON2C19H26 |
AB2C19D26 |
-18.94 |
2.42 |
-8.37 |
0.13 |
0 |
|
|
419140 |
135107588 |
1 |
ClN2O2C16H21 |
AB2C2D16E21 |
-85.28 |
6.82 |
-9.41 |
-0.71 |
0 |
|
|
419141 |
135107589 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-116.11 |
4.89 |
-8.64 |
-0.21 |
0 |
|
|
419142 |
135107598 |
1 |
ClSN2O5C15H21 |
ABC2D5E15F21 |
-193.81 |
5.22 |
-9.5 |
-0.62 |
0 |
|
|
419143 |
135107599 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-80.45 |
5.13 |
-9.23 |
-0.79 |
0 |
|
|
419145 |
135107601 |
1 |
FN3O5C18H24 |
AB3C5D18E24 |
-167.1 |
5.49 |
-9.02 |
-1.16 |
0 |
|
|
419146 |
135107602 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-36.43 |
4.67 |
-8.73 |
-0.63 |
0 |
|
|
419147 |
135107603 |
1 |
ON5C24H29 |
AB5C24D29 |
48.79 |
5.09 |
-8.87 |
-0.19 |
0 |
|
|
419148 |
135107604 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-70.49 |
4.73 |
-9.57 |
-1.36 |
0 |
|
|
419149 |
135107605 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-127.39 |
6.79 |
-8.8 |
-0.24 |
0 |
|
|
419150 |
135107606 |
1 |
OCl2N3C14H17 |
AB2C3D14E17 |
-16.77 |
5.01 |
-8.74 |
-0.64 |
0 |
|
|
419151 |
135107607 |
1 |
ClNSO3C18H26 |
ABCD3E18F26 |
-143.44 |
3.25 |
-9.21 |
-0.34 |
0 |
|
|
419152 |
135107611 |
1 |
FN3O4C19H24 |
AB3C4D19E24 |
-148.91 |
4.13 |
-8.9 |
-1.02 |
0 |
|
|
419153 |
135107612 |
1 |
N2O3C21H24 |
A2B3C21D24 |
-85.75 |
5.38 |
-9.01 |
-0.41 |
0 |
|
|
419154 |
135107613 |
1 |
ClON4C13H17 |
ABC4D13E17 |
6.12 |
3.74 |
-9.34 |
-0.6 |
0 |
|
|
419155 |
135107614 |
2 |
ON2C12H14 |
AB2C12D14 |
-45.42 |
3.9 |
-9.14 |
-0.66 |
0 |
|
|
419156 |
135107615 |
1 |
N2O5H22C23 |
A2B5C22D23 |
-142.8 |
5.37 |
-9.45 |
-1.05 |
0 |
|
|
419157 |
135107621 |
2 |
N3O3C18H25 |
A3B3C18D25 |
-225.95 |
3.09 |
-8.89 |
-0.12 |
0 |
|
|
419158 |
135107628 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-104.63 |
4.04 |
-9.49 |
-0.04 |
0 |
|
|
419159 |
135107631 |
1 |
ClO3N4C16H19 |
AB3C4D16E19 |
-60.58 |
5.16 |
-9.15 |
-0.59 |
0 |
|
|
419160 |
135107645 |
1 |
O2N5C17H23 |
A2B5C17D23 |
18.91 |
4.13 |
-8.68 |
-0.25 |
0 |
|
|
419161 |
135107658 |
1 |
NO2C24H27 |
AB2C24D27 |
-62.35 |
4.35 |
-9.24 |
0.16 |
0 |
|
|
419162 |
135107659 |
1 |
ClFN6O6C39H46 |
ABC6D6E39F46 |
-275.72 |
6.77 |
-9.43 |
-0.24 |
0 |
|
|
419163 |
135107664 |
1 |
ON4C17H28 |
AB4C17D28 |
-46.69 |
4.75 |
-8.53 |
-0.32 |
0 |
|
|
419164 |
135107665 |
1 |
FN2O2C15H19 |
AB2C2D15E19 |
-109.23 |
5.51 |
-9.22 |
-0.13 |
0 |
|
|
419165 |
135107666 |
2 |
ON2C7H9 |
AB2C7D9 |
-34.73 |
8.54 |
-9.8 |
-0.35 |
0 |
|
|
419166 |
135107667 |
1 |
SN4O4C16H28 |
AB4C4D16E28 |
-157.46 |
3.64 |
-9.07 |
0.17 |
0 |
|
|
419167 |
135107668 |
1 |
FN3O5C19H22 |
AB3C5D19E22 |
-189.69 |
3.16 |
-9.46 |
-1.6 |
0 |
|
|
419168 |
135107669 |
1 |
NF2O3C13H15 |
AB2C3D13E15 |
-208.39 |
4.91 |
-9.85 |
-0.63 |
0 |
|
|
419169 |
135107670 |
1 |
ClN2O3C16H19 |
AB2C3D16E19 |
-51.5 |
8.26 |
-9.36 |
-0.53 |
0 |
|
|
419170 |
135107671 |
1 |
SO5N9C39H49 |
AB5C9D39E49 |
-104.52 |
5.75 |
-9.12 |
-1.16 |
0 |
|
|
419171 |
135107672 |
1 |
ON5C23H25 |
AB5C23D25 |
36.46 |
7.6 |
-9.43 |
-0.98 |
0 |
|
|
419172 |
135107673 |
2 |
NO2C10H15 |
AB2C10D15 |
-168.95 |
5.52 |
-8.17 |
0.4 |
0 |
|
|
419173 |
135107674 |
1 |
NO4C20H27 |
AB4C20D27 |
-179.57 |
3.95 |
-9.5 |
-0.05 |
0 |
|
|
419174 |
135107675 |
1 |
SN6C17H24 |
AB6C17D24 |
71.66 |
4.92 |
-8.59 |
-0.46 |
0 |
|
|
419175 |
135107676 |
1 |
SN3O3C18H27 |
AB3C3D18E27 |
-114.63 |
4.39 |
-9.07 |
0.22 |
0 |
|
|
419176 |
135107677 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-73.43 |
6.45 |
-8.83 |
-0.53 |
0 |
|
|
419177 |
135107678 |
1 |
FON4C20H25 |
ABC4D20E25 |
-34.14 |
4.83 |
-8.9 |
-0.28 |
0 |
|
|
419178 |
135107679 |
1 |
OSN4C18H26 |
ABC4D18E26 |
-5.37 |
3.34 |
-8.73 |
-0.1 |
0 |
|
|
419179 |
135107680 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-65.88 |
4.26 |
-8.82 |
-0.91 |
0 |
|
|
419180 |
135107681 |
1 |
O6N7C35H49 |
A6B7C35D49 |
-240.94 |
8.48 |
-9.5 |
-0.4 |
0 |
|
|
419181 |
135107682 |
1 |
N4O4C13H16 |
A4B4C13D16 |
-102.67 |
4.03 |
-9.32 |
-0.54 |
0 |
|
|
419182 |
135107683 |
1 |
N2O5C17H20 |
A2B5C17D20 |
-168.21 |
6.75 |
-8.61 |
-0.59 |
0 |
|
|
419183 |
135107684 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-72.39 |
5.01 |
-8.31 |
-0.39 |
0 |
|
|
419184 |
135107685 |
2 |
NO2C8H11 |
AB2C8D11 |
-160.64 |
5.4 |
-9.48 |
-0.25 |
0 |
|
|
419185 |
135107686 |
1 |
N2S2O4C13H20 |
A2B2C4D13E20 |
-141.1 |
5.67 |
-8.88 |
-0.16 |
0 |
|
|
419186 |
135107687 |
1 |
S2O5N6C32H40 |
A2B5C6D32E40 |
-170.47 |
3.28 |
-8.71 |
-1.24 |
0 |
|
|
419187 |
135107688 |
1 |
ClFN4C20H24 |
ABC4D20E24 |
-1.92 |
1.52 |
-8.55 |
-0.36 |
0 |
|
|
419188 |
135107689 |
1 |
FO3N5C10H12 |
AB3C5D10E12 |
-26.75 |
5.32 |
-9.46 |
-0.71 |
0 |
|
|
419189 |
135107690 |
1 |
ON3C21H29 |
AB3C21D29 |
7.76 |
4.32 |
-8.66 |
0.15 |
0 |
|
|
419190 |
135107691 |
1 |
FO3N4C21H29 |
AB3C4D21E29 |
-93.17 |
6.47 |
-8.92 |
-0.97 |
0 |
|
|
419191 |
135107692 |
1 |
ClON4C16H21 |
ABC4D16E21 |
-5.23 |
5.3 |
-8.72 |
-0.3 |
0 |
|
|
419192 |
135107693 |
1 |
ON6C19H22 |
AB6C19D22 |
48.66 |
7.79 |
-8.88 |
-0.5 |
0 |
|
|
419193 |
135107694 |
1 |
SN8O8C39H52 |
AB8C8D39E52 |
-252.97 |
6.13 |
-8.69 |
-0.57 |
0 |
|
|
419194 |
135107695 |
1 |
NO6C16H19 |
AB6C16D19 |
-201.61 |
6.66 |
-9.16 |
-0.6 |
0 |
|
|
419195 |
135107696 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
-38.48 |
2.67 |
-9.15 |
-0.29 |
0 |
|
|
419196 |
135107701 |
1 |
SO2N4C11H16 |
AB2C4D11E16 |
15.69 |
2.17 |
-9.01 |
-0.57 |
0 |
|
|
419197 |
135107709 |
1 |
ON3C23H33 |
AB3C23D33 |
-14.23 |
2.64 |
-8.24 |
0.26 |
0 |
|
|
419198 |
135107727 |
2 |
ON2C10H13 |
AB2C10D13 |
-46.41 |
0.8 |
-9.25 |
-0.19 |
0 |
|
|
419199 |
135107728 |
1 |
SO5N8C38H46 |
AB5C8D38E46 |
-120.54 |
6.78 |
-9.09 |
-1.18 |
0 |
|
|
419200 |
135107729 |
1 |
ON5C20H25 |
AB5C20D25 |
14.36 |
4.19 |
-8.64 |
-0.42 |
0 |
|
|
419201 |
135107730 |
1 |
O5N6C28H40 |
A5B6C28D40 |
-186.16 |
8.97 |
-9.05 |
-0.09 |
0 |
|
|
419202 |
135107731 |
1 |
OSN3C14H17 |
ABC3D14E17 |
31.51 |
2.71 |
-8.7 |
-0.57 |
0 |
|
|
419203 |
135107732 |
1 |
FSO6N7C36H44 |
ABC6D7E36F44 |
-252.21 |
4.53 |
-9.32 |
-1.03 |
0 |
|
|
419204 |
135107733 |
1 |
FN3O3C18H26 |
AB3C3D18E26 |
-145.34 |
2.13 |
-9.07 |
-0.25 |
0 |
|
|
419205 |
135107742 |
1 |
SO4N5C21H23 |
AB4C5D21E23 |
-104.9 |
6.49 |
-9.06 |
-1.45 |
0 |
|
|
419206 |
135107743 |
2 |
ON3C11H19 |
AB3C11D19 |
-89.16 |
6.64 |
-8.75 |
0.65 |
0 |
|
|
419207 |
135107744 |
2 |
ON2C12H13 |
AB2C12D13 |
-1.16 |
2.25 |
-8.45 |
-0.32 |
0 |
|
|
419208 |
135107745 |
1 |
OCl2N4C17H22 |
AB2C4D17E22 |
-22.99 |
6.49 |
-9.02 |
-0.26 |
0 |
|
|
419209 |
135107746 |
1 |
NOF2C16H21 |
ABC2D16E21 |
-137.23 |
2.8 |
-9.05 |
-0.19 |
0 |
|
|
419210 |
135107747 |
1 |
SO2N4C20H20 |
AB2C4D20E20 |
9.54 |
7.54 |
-9.28 |
-0.73 |
0 |
|
|
419211 |
135107748 |
2 |
ON3C9H12 |
AB3C9D12 |
-15.62 |
7.11 |
-9.71 |
-0.71 |
0 |
|
|
419212 |
135107749 |
1 |
N3O3C23H27 |
A3B3C23D27 |
-64.74 |
4.9 |
-8.68 |
-0.11 |
0 |
|
|
419213 |
135107750 |
1 |
SN2O4C18H22 |
AB2C4D18E22 |
-125.72 |
4.82 |
-9.11 |
-0.68 |
0 |
|
|
419214 |
135107756 |
1 |
N6O6C35H42 |
A6B6C35D42 |
-197.73 |
7.49 |
-9.17 |
-0.82 |
0 |
|
|
419215 |
135107757 |
1 |
O2N5C21H23 |
A2B5C21D23 |
-9.39 |
3.71 |
-8.32 |
-0.4 |
0 |
|
|
419216 |
135107758 |
1 |
ON6C19H26 |
AB6C19D26 |
10.18 |
9.63 |
-8.79 |
-0.24 |
0 |
|
|
419220 |
135107762 |
1 |
FN2O5C17H19 |
AB2C5D17E19 |
-169.84 |
2.56 |
-9.43 |
-1.58 |
0 |
|
|
419221 |
135107763 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-60.22 |
2.88 |
-9.15 |
-0.88 |
0 |
|
|
419222 |
135107764 |
1 |
O5N6C32H42 |
A5B6C32D42 |
-162.8 |
5.87 |
-8.6 |
-0.13 |
0 |
|
|
419223 |
135107765 |
1 |
F2N3O4C17H19 |
A2B3C4D17E19 |
-173.47 |
1.47 |
-9.12 |
-1.23 |
0 |
|
|
419224 |
135107766 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-24.67 |
3.54 |
-9.62 |
-0.79 |
0 |
|
|
419225 |
135107768 |
1 |
ClNSO3C16H22 |
ABCD3E16F22 |
-122.74 |
5.44 |
-9.38 |
-0.78 |
0 |
|
|
419226 |
135107769 |
1 |
ClO2N4C17H21 |
AB2C4D17E21 |
23.11 |
3.82 |
-8.93 |
-0.89 |
0 |
|
|
419227 |
135107770 |
1 |
SO6N8C38H46 |
AB6C8D38E46 |
-170.47 |
5.87 |
-8.65 |
-1.05 |
0 |
|
|
419228 |
135107771 |
1 |
SN2O5C18H28 |
AB2C5D18E28 |
-212.9 |
8.37 |
-9.11 |
0.06 |
0 |
|
|
419229 |
135107804 |
3 |
O2N3C12H17 |
A2B3C12D17 |
-209.6 |
10.61 |
-9.12 |
-1.08 |
0 |
|
|
419230 |
135107805 |
1 |
ClO3N5C21H26 |
AB3C5D21E26 |
-69.53 |
3.51 |
-9.68 |
-0.56 |
0 |
|
|
419231 |
135107806 |
1 |
ClN2O3C16H21 |
AB2C3D16E21 |
-97.79 |
6.22 |
-8.89 |
-0.45 |
0 |
|
|
419232 |
135107807 |
2 |
ON2C10H11 |
AB2C10D11 |
-1.52 |
3.86 |
-9.37 |
-0.48 |
0 |
|
|
419233 |
135107808 |
2 |
ON2C7H8 |
AB2C7D8 |
-17.28 |
6.85 |
-9.39 |
-0.42 |
0 |
|
|
419234 |
135107809 |
1 |
N2O2C19H26 |
A2B2C19D26 |
-47.95 |
3.41 |
-8.72 |
0.31 |
0 |