List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
17100 |
484181 |
1 |
ClN2O2F4H17C22 |
AB2C2D4E17F22 |
-176.6 |
2.63 |
-8.55 |
-0.8 |
0 |
|
|
17101 |
484226 |
2 |
N2O3C20H26 |
A2B3C20D26 |
-252.53 |
6.61 |
-9.25 |
-0.94 |
0 |
|
|
17102 |
484263 |
1 |
FO6N20C42H77 |
AB6C20D42E77 |
-269.21 |
8.5 |
-9.0 |
-0.42 |
0 |
|
|
17103 |
484334 |
1 |
S2N7O7C45H63 |
A2B7C7D45E63 |
-297.31 |
3.98 |
-9.13 |
-0.19 |
0 |
|
|
17104 |
484406 |
2 |
O3C13H20 |
A3B13C20 |
-298.31 |
2.44 |
-8.67 |
0.28 |
0 |
|
|
17105 |
484412 |
1 |
BrOC21H31 |
ABC21D31 |
-69.11 |
2.41 |
-8.75 |
0.08 |
0 |
|
|
17106 |
484413 |
1 |
NOC21H33 |
ABC21D33 |
-72.97 |
0.69 |
-8.09 |
0.48 |
0 |
|
|
17107 |
484448 |
1 |
O3C22H30 |
A3B22C30 |
-121.67 |
2.32 |
-9.02 |
0.02 |
0 |
|
|
17108 |
484449 |
2 |
OC10H14 |
AB10C14 |
-78.74 |
3.25 |
-8.75 |
0.04 |
0 |
|
|
17109 |
484452 |
2 |
OC10H14 |
AB10C14 |
-99.56 |
2.18 |
-8.62 |
-0.12 |
0 |
|
|
17110 |
484454 |
1 |
F2N2O6H14C21 |
A2B2C6D14E21 |
-269.54 |
4.95 |
-9.51 |
-2.02 |
0 |
|
|
17111 |
484455 |
1 |
N3C27H29 |
A3B27C29 |
103.21 |
5.74 |
-9.04 |
-0.18 |
0 |
|
|
17112 |
484456 |
2 |
N2C13H14 |
A2B13C14 |
119.5 |
7.75 |
-9.36 |
-0.5 |
0 |
|
|
17113 |
484512 |
1 |
SO2N6H14C15 |
AB2C6D14E15 |
65.77 |
7.31 |
-8.93 |
-1.47 |
0 |
|
|
17114 |
484531 |
1 |
OPS2N4H25C35 |
ABC2D4E25F35 |
125.56 |
13.13 |
-8.02 |
-0.72 |
0 |
|
|
17115 |
484573 |
1 |
S2N6O14C37H48 |
A2B6C14D37E48 |
-614.64 |
15.28 |
-8.96 |
-0.64 |
0 |
|
|
17116 |
484578 |
1 |
SN3O3C29H41 |
AB3C3D29E41 |
-115.56 |
10.11 |
-8.72 |
-0.52 |
0 |
|
|
17117 |
484587 |
1 |
O7C25H28 |
A7B25C28 |
-284.29 |
3.21 |
-8.91 |
-0.68 |
0 |
|
|
17118 |
484605 |
1 |
NO14C71H107 |
AB14C71D107 |
-679.64 |
7.49 |
-8.91 |
-1.86 |
0 |
|
|
17119 |
484608 |
1 |
NO14C36H37 |
AB14C36D37 |
-502.59 |
8.77 |
-8.77 |
-2.0 |
0 |
|
|
17120 |
484618 |
2 |
ON3C10H15 |
AB3C10D15 |
-13.31 |
1.61 |
-7.83 |
-0.35 |
0 |
|
|
17121 |
484621 |
1 |
O2N3H9C14 |
A2B3C9D14 |
26.66 |
6.46 |
-8.62 |
-1.0 |
0 |
|
|
17122 |
484659 |
1 |
N7O12C47H79 |
A7B12C47D79 |
-597.39 |
7.04 |
-9.25 |
-0.04 |
0 |
|
|
17123 |
484672 |
1 |
N3O9C36H53 |
A3B9C36D53 |
-420.41 |
4.75 |
-8.5 |
-0.4 |
0 |
|
|
17124 |
484717 |
1 |
N5O5H9C12 |
A5B5C9D12 |
21.04 |
1.9 |
-10.29 |
-2.52 |
0 |
|
|
17125 |
484742 |
1 |
P2N15O17C63H89 |
A2B15C17D63E89 |
-757.12 |
4.96 |
-8.44 |
-0.82 |
0 |
|
|
17126 |
484744 |
1 |
ClO3N4H9C12 |
AB3C4D9E12 |
14.42 |
4.18 |
-9.91 |
-2.17 |
0 |
|
|
17127 |
484968 |
2 |
ClO2H6C10 |
AB2C6D10 |
-103.23 |
4.98 |
-9.37 |
-1.04 |
0 |
|
|
17128 |
484979 |
2 |
O2H9C13 |
A2B9C13 |
-74.98 |
6.12 |
-9.04 |
-1.06 |
0 |
|
|
17129 |
485003 |
1 |
O2N3H17C18 |
A2B3C17D18 |
-1.53 |
3.6 |
-8.93 |
-1.33 |
0 |
|
|
17130 |
485117 |
1 |
SN2O3H16C17 |
AB2C3D16E17 |
-80.7 |
11.99 |
-9.46 |
-1.52 |
0 |
|
|
17131 |
485147 |
1 |
N14O25C73H118 |
A14B25C73D118 |
-1244.06 |
6.29 |
-9.49 |
-0.51 |
0 |
|
|
17132 |
485149 |
1 |
N16O23C75H126 |
A16B23C75D126 |
-1134.05 |
12.08 |
-8.79 |
-0.28 |
0 |
|
|
17133 |
485204 |
2 |
N4O7C31H40 |
A4B7C31D40 |
-610.69 |
4.27 |
-8.72 |
-0.49 |
0 |
|
|
17134 |
485359 |
1 |
N4O7C37H40 |
A4B7C37D40 |
-199.51 |
4.33 |
-8.52 |
0.01 |
0 |
|
|
17135 |
485430 |
1 |
NCl2C10H13 |
AB2C10D13 |
-7.7 |
1.81 |
-9.16 |
-0.47 |
0 |
|
|
17136 |
485431 |
1 |
NCl2C11H15 |
AB2C11D15 |
-10.7 |
2.06 |
-9.23 |
-0.36 |
0 |
|
|
17138 |
485520 |
1 |
PN5O9C10H16 |
AB5C9D10E16 |
-341.98 |
9.06 |
-9.23 |
-1.02 |
0 |
|
|
17139 |
485521 |
1 |
O8H12C15 |
A8B12C15 |
-296.68 |
3.8 |
-9.06 |
-0.99 |
0 |
|
|
17140 |
485635 |
1 |
S6O9N14C52H54 |
A6B9C14D52E54 |
-143.29 |
1.72 |
-8.94 |
-1.95 |
0 |
|
|
17141 |
485747 |
1 |
FN4O4H17C18 |
AB4C4D17E18 |
-157.13 |
4.92 |
-9.28 |
-0.84 |
0 |
|
|
17142 |
485794 |
1 |
FS3O4N5C17H20 |
AB3C4D5E17F20 |
-123.41 |
3.7 |
-9.2 |
-1.3 |
0 |
|
|
17143 |
485796 |
1 |
FO2S2N5C18H22 |
AB2C2D5E18F22 |
-62.09 |
4.55 |
-9.13 |
-1.24 |
0 |
|
|
17144 |
485819 |
1 |
O4C25H34 |
A4B25C34 |
-110.98 |
4.49 |
-8.97 |
0.02 |
0 |
|
|
17145 |
485821 |
2 |
O2C12H17 |
A2B12C17 |
-124.92 |
4.49 |
-9.24 |
0.08 |
0 |
|
|
17146 |
485894 |
1 |
SO3F4N5H19C22 |
AB3C4D5E19F22 |
-180.82 |
2.72 |
-10.01 |
-0.97 |
0 |
|
|
17147 |
485977 |
1 |
SN6O8C32H50 |
AB6C8D32E50 |
-359.35 |
7.34 |
-8.8 |
-0.15 |
0 |
|
|
17148 |
486011 |
1 |
N2O4C39H42 |
A2B4C39D42 |
-116.44 |
6.55 |
-9.28 |
-0.17 |
0 |
|
|
17149 |
486045 |
1 |
SN4O5C34H64 |
AB4C5D34E64 |
-301.76 |
7.32 |
-8.81 |
-1.0 |
0 |
|
|
17150 |
486248 |
1 |
O4C11H18 |
A4B11C18 |
-199.85 |
3.71 |
-10.66 |
-0.35 |
0 |