List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
422633 |
135118169 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-88.02 |
7.75 |
-8.97 |
-0.44 |
0 |
|
|
422634 |
135118170 |
1 |
ClN5O6C34H46 |
AB5C6D34E46 |
-267.52 |
8.33 |
-8.98 |
-0.72 |
0 |
|
|
422635 |
135118171 |
1 |
NO3C13H23 |
AB3C13D23 |
-162.86 |
5.4 |
-8.98 |
0.75 |
0 |
|
|
422636 |
135118172 |
2 |
NO3C15H16 |
AB3C15D16 |
-87.93 |
6.33 |
-8.18 |
-0.96 |
0 |
|
|
422637 |
135118173 |
1 |
FO2N3C15H16 |
AB2C3D15E16 |
-60.36 |
5.42 |
-9.03 |
-0.68 |
0 |
|
|
422638 |
135118175 |
1 |
NSO2C18H21 |
ABC2D18E21 |
-67.32 |
3.56 |
-8.79 |
-0.65 |
0 |
|
|
422640 |
135118177 |
1 |
N3O4C22H31 |
A3B4C22D31 |
-124.63 |
1.85 |
-8.74 |
0.02 |
0 |
|
|
422641 |
135118178 |
1 |
FN2O2C18H25 |
AB2C2D18E25 |
-130.0 |
3.58 |
-8.99 |
-0.43 |
0 |
|
|
422642 |
135118180 |
1 |
S2N3O3C16H19 |
A2B3C3D16E19 |
-62.82 |
4.68 |
-8.76 |
-1.1 |
0 |
|
|
422643 |
135118181 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-70.86 |
4.65 |
-9.18 |
-0.35 |
0 |
|
|
422644 |
135118183 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-33.72 |
3.88 |
-9.32 |
-0.56 |
0 |
|
|
422645 |
135118184 |
1 |
FNO3C22H24 |
ABC3D22E24 |
-139.31 |
6.51 |
-9.14 |
-0.08 |
0 |
|
|
422646 |
135118185 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-32.73 |
2.4 |
-8.71 |
-0.7 |
0 |
|
|
422647 |
135118186 |
1 |
N2O3C25H30 |
A2B3C25D30 |
-71.08 |
4.25 |
-8.24 |
-0.64 |
0 |
|
|
422648 |
135118188 |
1 |
N3O4C16H25 |
A3B4C16D25 |
-173.33 |
4.55 |
-9.23 |
0.13 |
0 |
|
|
422649 |
135118191 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-186.55 |
0.82 |
-9.43 |
0.0 |
0 |
|
|
422650 |
135118193 |
1 |
N3O5C19H25 |
A3B5C19D25 |
-137.48 |
2.53 |
-9.68 |
-0.39 |
0 |
|
|
422651 |
135118194 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-75.9 |
5.21 |
-8.77 |
0.15 |
0 |
|
|
422652 |
135118195 |
2 |
ON2C9H14 |
AB2C9D14 |
-85.6 |
5.48 |
-8.91 |
0.06 |
0 |
|
|
422653 |
135118196 |
1 |
O3N4C18H26 |
A3B4C18D26 |
-121.26 |
4.12 |
-9.59 |
-0.89 |
0 |
|
|
422655 |
135118198 |
1 |
SO7N9C37H47 |
AB7C9D37E47 |
-191.58 |
8.76 |
-8.7 |
-1.41 |
0 |
|
|
422656 |
135118199 |
1 |
FNSO5C17H22 |
ABCD5E17F22 |
-237.64 |
8.58 |
-9.81 |
-1.1 |
0 |
|
|
422657 |
135118202 |
1 |
O2N3C17H29 |
A2B3C17D29 |
-98.5 |
4.55 |
-9.22 |
0.42 |
0 |
|
|
422658 |
135118203 |
1 |
SN2O5C17H24 |
AB2C5D17E24 |
-200.83 |
5.16 |
-9.5 |
-0.69 |
0 |
|
|
422659 |
135118204 |
1 |
O3N4C23H30 |
A3B4C23D30 |
-45.39 |
4.98 |
-8.86 |
-0.99 |
0 |
|
|
422661 |
135118206 |
1 |
FO2N3C15H20 |
AB2C3D15E20 |
-74.62 |
5.46 |
-9.07 |
-0.31 |
0 |
|
|
422662 |
135118208 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-85.85 |
4.45 |
-9.24 |
-0.34 |
0 |
|
|
422663 |
135118210 |
1 |
ON5C18H29 |
AB5C18D29 |
-32.37 |
0.98 |
-8.44 |
0.57 |
0 |
|
|
422664 |
135118211 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-139.85 |
4.75 |
-9.75 |
-0.45 |
0 |
|
|
422665 |
135118213 |
1 |
OF3N3C16H22 |
AB3C3D16E22 |
-181.92 |
2.61 |
-8.86 |
-0.62 |
0 |
|
|
422666 |
135118217 |
1 |
FN4O4C20H27 |
AB4C4D20E27 |
-139.99 |
2.36 |
-9.01 |
-1.05 |
0 |
|
|
422667 |
135118218 |
1 |
N2F3O5H11C14 |
A2B3C5D11E14 |
-302.56 |
7.74 |
-10.68 |
-1.74 |
0 |
|
|
422668 |
135118219 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-84.01 |
3.06 |
-9.26 |
-1.09 |
0 |
|
|
422669 |
135118220 |
1 |
ON4C19H26 |
AB4C19D26 |
-0.58 |
4.79 |
-9.05 |
0.46 |
0 |
|
|
422670 |
135118221 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-18.96 |
4.16 |
-9.0 |
-0.6 |
0 |
|
|
422671 |
135118223 |
1 |
FNO4C21H24 |
ABC4D21E24 |
-181.12 |
1.97 |
-9.03 |
-0.14 |
0 |
|
|
422672 |
135118224 |
1 |
O6N7C37H47 |
A6B7C37D47 |
-192.01 |
2.57 |
-8.99 |
-0.97 |
0 |
|
|
422673 |
135118226 |
1 |
ON3C18H25 |
AB3C18D25 |
25.75 |
4.18 |
-9.14 |
-0.18 |
0 |
|
|
422674 |
135118227 |
1 |
N3O4C20H25 |
A3B4C20D25 |
-35.64 |
9.95 |
-8.8 |
-0.76 |
0 |
|
|
422675 |
135118229 |
1 |
F2N2O3C19H22 |
A2B2C3D19E22 |
-199.95 |
5.58 |
-9.49 |
-0.4 |
0 |
|
|
422676 |
135118231 |
1 |
FON3C23H26 |
ABC3D23E26 |
-29.77 |
3.42 |
-9.19 |
-0.19 |
0 |
|
|
422678 |
135118234 |
1 |
O2N4C15H20 |
A2B4C15D20 |
11.87 |
3.26 |
-8.56 |
-0.24 |
0 |
|
|
422679 |
135118235 |
2 |
NOC10H13 |
ABC10D13 |
-74.96 |
3.59 |
-8.49 |
-0.12 |
0 |
|
|
422681 |
135118238 |
1 |
NO2C19H29 |
AB2C19D29 |
-87.54 |
0.57 |
-8.69 |
0.4 |
0 |
|
|
422683 |
135118243 |
1 |
ON4C20H30 |
AB4C20D30 |
-20.35 |
4.56 |
-8.59 |
0.12 |
0 |
|
|
422684 |
135118244 |
1 |
SO4N5C16H25 |
AB4C5D16E25 |
-143.88 |
3.51 |
-9.04 |
-0.52 |
0 |
|
|
422685 |
135118245 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-67.83 |
2.67 |
-9.08 |
-0.14 |
0 |
|
|
422686 |
135118246 |
1 |
N4C15H26 |
A4B15C26 |
0.72 |
2.74 |
-8.76 |
0.0 |
0 |
|
|
422687 |
135118248 |
1 |
FO4N6C26H29 |
AB4C6D26E29 |
-129.68 |
4.12 |
-8.93 |
-0.76 |
0 |
|
|
422688 |
135118249 |
1 |
ON2C22H26 |
AB2C22D26 |
9.22 |
2.42 |
-8.59 |
-0.26 |
0 |
|
|
422689 |
135118250 |
1 |
NO5C21H33 |
AB5C21D33 |
-235.98 |
4.64 |
-8.88 |
0.03 |
0 |
|
|
422690 |
135118253 |
1 |
N2O5C20H28 |
A2B5C20D28 |
-165.02 |
5.28 |
-8.94 |
0.09 |
0 |
|
|
422691 |
135118255 |
1 |
ClON4C20H27 |
ABC4D20E27 |
-1.55 |
2.76 |
-8.84 |
-0.58 |
0 |
|
|
422692 |
135118257 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-37.25 |
3.84 |
-8.8 |
0.63 |
0 |
|
|
422693 |
135118258 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-59.23 |
1.83 |
-8.91 |
-0.81 |
0 |
|
|
422694 |
135118259 |
1 |
N3O3C21H25 |
A3B3C21D25 |
1.93 |
3.33 |
-9.16 |
-0.24 |
0 |
|
|
422695 |
135118260 |
1 |
NO2C24H29 |
AB2C24D29 |
-74.03 |
6.31 |
-9.02 |
-0.01 |
0 |
|
|
422696 |
135118261 |
1 |
OSN3C19H25 |
ABC3D19E25 |
-3.49 |
2.25 |
-8.77 |
-0.75 |
0 |
|
|
422697 |
135118262 |
1 |
ON3C17H25 |
AB3C17D25 |
-4.25 |
2.93 |
-9.11 |
0.43 |
0 |
|
|
422698 |
135118265 |
1 |
SO2N4C19H20 |
AB2C4D19E20 |
23.67 |
4.65 |
-9.29 |
-0.8 |
0 |
|
|
422699 |
135118266 |
1 |
N4O4C21H30 |
A4B4C21D30 |
-132.85 |
5.78 |
-8.77 |
-0.29 |
0 |
|
|
422700 |
135118267 |
1 |
N2O2F3C18H25 |
A2B2C3D18E25 |
-237.78 |
4.66 |
-8.9 |
-0.22 |
0 |
|
|
422701 |
135118272 |
1 |
N7C19H21 |
A7B19C21 |
130.24 |
6.31 |
-9.41 |
-0.81 |
0 |
|
|
422702 |
135118273 |
1 |
S2O6N9C36H49 |
A2B6C9D36E49 |
-168.96 |
8.48 |
-8.28 |
-0.99 |
0 |
|
|
422703 |
135118274 |
1 |
OSN7C18H21 |
ABC7D18E21 |
73.98 |
5.34 |
-8.56 |
-1.52 |
0 |
|
|
422704 |
135118275 |
1 |
O4N5C26H31 |
A4B5C26D31 |
-57.65 |
3.99 |
-8.53 |
-0.13 |
0 |
|
|
422705 |
135118276 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-12.35 |
4.36 |
-9.03 |
-0.4 |
0 |
|
|
422706 |
135118279 |
1 |
ClON4C13H23 |
ABC4D13E23 |
-9.4 |
4.61 |
-8.74 |
0.33 |
0 |
|
|
422707 |
135118282 |
1 |
ON5C21H23 |
AB5C21D23 |
74.87 |
3.81 |
-9.19 |
-0.84 |
0 |
|
|
422709 |
135118284 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-46.32 |
5.47 |
-8.76 |
-0.66 |
0 |
|
|
422710 |
135118285 |
1 |
ClFN2O2C15H18 |
ABC2D2E15F18 |
-103.34 |
5.88 |
-8.93 |
-0.61 |
0 |
|
|
422711 |
135118286 |
1 |
ON3C21H25 |
AB3C21D25 |
20.86 |
4.18 |
-8.63 |
-0.47 |
0 |
|
|
422712 |
135118289 |
1 |
ON6C16H18 |
AB6C16D18 |
46.85 |
2.7 |
-8.53 |
-0.03 |
0 |
|
|
422713 |
135118290 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-58.78 |
4.4 |
-9.14 |
0.1 |
0 |
|
|
422714 |
135118291 |
1 |
F2N7O7C44H53 |
A2B7C7D44E53 |
-341.86 |
7.67 |
-8.4 |
-1.0 |
0 |
|
|
422715 |
135118293 |
1 |
SO3N5C18H19 |
AB3C5D18E19 |
-22.68 |
10.34 |
-9.37 |
-1.22 |
0 |
|
|
422716 |
135118294 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-45.27 |
6.4 |
-8.86 |
-0.74 |
0 |
|
|
422718 |
135118296 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-56.46 |
4.83 |
-9.06 |
-0.93 |
0 |
|
|
422719 |
135118297 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-71.83 |
3.98 |
-9.05 |
-0.23 |
0 |
|
|
422720 |
135118298 |
1 |
FSN3O3C18H18 |
ABC3D3E18F18 |
-53.22 |
4.95 |
-9.08 |
-1.08 |
0 |
|
|
422721 |
135118299 |
1 |
NSO4C18H27 |
ABC4D18E27 |
-165.71 |
5.46 |
-9.17 |
-0.31 |
0 |
|
|
422722 |
135118300 |
1 |
NSO4C20H21 |
ABC4D20E21 |
-111.45 |
5.06 |
-8.94 |
-0.29 |
0 |
|
|
422723 |
135118301 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-66.27 |
3.91 |
-8.54 |
-0.24 |
0 |
|
|
422724 |
135118302 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-97.5 |
6.04 |
-8.98 |
-0.09 |
0 |
|
|
422725 |
135118303 |
1 |
SN2O2C18H20 |
AB2C2D18E20 |
-37.08 |
6.91 |
-9.2 |
-0.45 |
0 |
|
|
422726 |
135118304 |
1 |
FN2O2C16H21 |
AB2C2D16E21 |
-50.94 |
3.79 |
-8.88 |
-0.15 |
0 |
|
|
422727 |
135118306 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-100.8 |
5.31 |
-9.19 |
-0.83 |
0 |
|
|
422728 |
135118308 |
1 |
ON3C19H25 |
AB3C19D25 |
-16.75 |
0.98 |
-8.13 |
-0.13 |
0 |
|
|
422729 |
135118309 |
1 |
ClN2O3C20H21 |
AB2C3D20E21 |
-80.8 |
6.22 |
-9.2 |
-0.82 |
0 |
|
|
422730 |
135118312 |
1 |
ClN2O2C22H25 |
AB2C2D22E25 |
-48.14 |
8.01 |
-8.92 |
-0.25 |
0 |
|
|
422731 |
135118313 |
1 |
SO3N6C12H18 |
AB3C6D12E18 |
-56.64 |
7.91 |
-9.25 |
-0.51 |
0 |
|
|
422733 |
135118316 |
2 |
ON2C11H15 |
AB2C11D15 |
-59.36 |
5.22 |
-8.67 |
-0.62 |
0 |
|
|
422734 |
135118318 |
2 |
OF2N2C7H7 |
AB2C2D7E7 |
-220.67 |
5.2 |
-10.14 |
-0.91 |
0 |
|
|
422735 |
135118321 |
1 |
N4O4C17H20 |
A4B4C17D20 |
-126.82 |
3.74 |
-10.06 |
-1.17 |
0 |
|
|
422736 |
135118322 |
1 |
F2N3O3C16H19 |
A2B3C3D16E19 |
-178.07 |
5.34 |
-9.16 |
-0.86 |
0 |
|
|
422737 |
135118323 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-32.01 |
3.37 |
-8.66 |
0.22 |
0 |
|
|
422738 |
135118325 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-90.72 |
2.33 |
-9.2 |
0.49 |
0 |
|
|
422739 |
135118327 |
1 |
O2N3C25H27 |
A2B3C25D27 |
-14.02 |
8.92 |
-9.25 |
-0.51 |
0 |
|
|
422740 |
135118328 |
1 |
N2O2F3C17H21 |
A2B2C3D17E21 |
-208.34 |
2.83 |
-9.19 |
-1.14 |
0 |
|
|
422741 |
135118329 |
1 |
FNO2C18H24 |
ABC2D18E24 |
-134.29 |
6.07 |
-8.92 |
-0.08 |
0 |