List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
341409 |
127264102 |
1 |
NO3C16H17 |
AB3C16D17 |
-61.08 |
3.2 |
-9.04 |
-0.77 |
0 |
|
|
341410 |
127264103 |
1 |
OC14H18 |
AB14C18 |
-47.21 |
4.06 |
-9.4 |
0.0 |
0 |
|
|
341411 |
127264104 |
1 |
O4C17H20 |
A4B17C20 |
-150.09 |
4.1 |
-9.65 |
-0.56 |
0 |
|
|
341412 |
127264105 |
1 |
NO3C17H19 |
AB3C17D19 |
-66.34 |
3.34 |
-9.03 |
-0.77 |
0 |
|
|
341413 |
127264106 |
1 |
OC15H20 |
AB15C20 |
-53.28 |
3.92 |
-9.35 |
0.05 |
0 |
|
|
341414 |
127264107 |
2 |
O2C9H11 |
A2B9C11 |
-156.22 |
4.19 |
-9.6 |
-0.55 |
0 |
|
|
341415 |
127264108 |
1 |
NO3C18H21 |
AB3C18D21 |
-72.39 |
3.36 |
-9.01 |
-0.75 |
0 |
|
|
341416 |
127264109 |
1 |
O5C16H18 |
A5B16C18 |
-187.73 |
5.71 |
-9.36 |
-0.56 |
0 |
|
|
341417 |
127264110 |
1 |
NO4C16H17 |
AB4C16D17 |
-96.52 |
4.3 |
-8.72 |
-0.73 |
0 |
|
|
341418 |
127264111 |
1 |
O5C15H16 |
A5B15C16 |
-172.81 |
4.06 |
-9.3 |
-0.56 |
0 |
|
|
341419 |
127264112 |
1 |
NO4C15H15 |
AB4C15D15 |
-88.83 |
2.96 |
-8.81 |
-0.72 |
0 |
|
|
341420 |
127264113 |
1 |
SO5C14H14 |
AB5C14D14 |
-160.3 |
3.99 |
-9.13 |
-0.74 |
0 |
|
|
341421 |
127264114 |
1 |
NSO4H13C14 |
ABC4D13E14 |
-74.27 |
3.35 |
-8.83 |
-0.92 |
0 |
|
|
341422 |
127264115 |
1 |
SO4H12C13 |
AB4C12D13 |
-118.57 |
3.06 |
-9.1 |
-0.81 |
0 |
|
|
341423 |
127264116 |
1 |
NSO3H11C13 |
ABC3D11E13 |
-32.87 |
2.43 |
-8.91 |
-1.01 |
0 |
|
|
341424 |
127264117 |
1 |
SF3O3C11H11 |
AB3C3D11E11 |
-275.75 |
1.88 |
-9.06 |
-0.63 |
0 |
|
|
341425 |
127264118 |
1 |
SO2F3H9C11 |
AB2C3D9E11 |
-220.09 |
4.11 |
-9.2 |
-0.92 |
0 |
|
|
341426 |
127264119 |
1 |
SF3O4H11C14 |
AB3C4D11E14 |
-279.77 |
2.37 |
-9.41 |
-1.31 |
0 |
|
|
341427 |
127264120 |
1 |
NSF3O3H10C14 |
ABC3D3E10F14 |
-194.12 |
3.1 |
-9.2 |
-1.55 |
0 |
|
|
341428 |
127264121 |
1 |
NSF3O3H8C13 |
ABC3D3E8F13 |
-195.51 |
1.56 |
-9.36 |
-1.74 |
0 |
|
|
341429 |
127264122 |
1 |
Cl2O4H12C15 |
A2B4C12D15 |
-105.3 |
2.63 |
-9.98 |
-0.9 |
0 |
|
|
341430 |
127264123 |
1 |
NCl2O3H11C15 |
AB2C3D11E15 |
-31.43 |
2.49 |
-9.45 |
-1.04 |
0 |
|
|
341431 |
127264124 |
1 |
NCl2O3H9C14 |
AB2C3D9E14 |
-14.44 |
6.98 |
-9.74 |
-1.38 |
0 |
|
|
341432 |
127264125 |
1 |
O4C15H16 |
A4B15C16 |
-133.04 |
3.34 |
-9.68 |
-0.61 |
0 |
|
|
341433 |
127264126 |
1 |
NO3C15H15 |
AB3C15D15 |
7.41 |
2.63 |
-9.25 |
-0.85 |
0 |
|
|
341434 |
127264127 |
1 |
O6C15H16 |
A6B15C16 |
-207.52 |
3.43 |
-9.24 |
-0.63 |
0 |
|
|
341435 |
127264128 |
1 |
NO5C15H15 |
AB5C15D15 |
-56.98 |
2.55 |
-8.94 |
-0.81 |
0 |
|
|
341436 |
127264129 |
1 |
OF2N2H8C10 |
AB2C2D8E10 |
-76.26 |
2.13 |
-9.36 |
-0.58 |
0 |
|
|
341437 |
127264130 |
1 |
OF2N2H10C11 |
AB2C2D10E11 |
-73.98 |
5.73 |
-9.02 |
-0.57 |
0 |
|
|
341438 |
127264131 |
1 |
ClON2C12H13 |
ABC2D12E13 |
0.28 |
4.49 |
-8.98 |
-0.14 |
0 |
|
|
341439 |
127264132 |
1 |
FON2C11H11 |
ABC2D11E11 |
-39.28 |
4.21 |
-9.26 |
-0.19 |
0 |
|
|
341440 |
127264133 |
1 |
FON2C12H13 |
ABC2D12E13 |
-36.61 |
4.58 |
-9.0 |
-0.13 |
0 |
|
|
341441 |
127264134 |
1 |
BrClNO2C11H13 |
ABCD2E11F13 |
-82.4 |
2.84 |
-9.77 |
-1.1 |
0 |
|
|
341442 |
127264135 |
1 |
ON2C18H28 |
AB2C18D28 |
-43.08 |
2.05 |
-8.66 |
0.34 |
0 |
|
|
341443 |
127264136 |
1 |
BN2O2C14H19 |
AB2C2D14E19 |
-124.77 |
6.19 |
-8.52 |
-0.12 |
0 |
|
|
341444 |
127264137 |
1 |
FN2O5C17H23 |
AB2C5D17E23 |
-192.84 |
4.34 |
-9.69 |
-1.62 |
0 |
|
|
341445 |
127264138 |
1 |
FN2O3C17H25 |
AB2C3D17E25 |
-190.09 |
2.98 |
-8.55 |
0.14 |
0 |
|
|
341446 |
127264139 |
1 |
N3O3C16H25 |
A3B3C16D25 |
-135.38 |
2.47 |
-8.42 |
-0.2 |
0 |
|
|
341447 |
127264140 |
2 |
ClNC5H5 |
ABC5D5 |
55.1 |
0.96 |
-10.22 |
-1.02 |
0 |
|
|
341448 |
127264141 |
1 |
ClN2O2C13H13 |
AB2C2D13E13 |
-31.52 |
2.07 |
-8.85 |
-0.76 |
0 |
|
|
341449 |
127264142 |
1 |
BrClON3H13C14 |
ABCD3E13F14 |
28.04 |
2.92 |
-9.37 |
-1.22 |
0 |
|
|
341450 |
127264143 |
1 |
FN2C7H9 |
AB2C7D9 |
9.16 |
1.93 |
-9.6 |
0.42 |
0 |
|
|
341451 |
127264144 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-162.28 |
3.75 |
-8.41 |
-0.12 |
0 |
|
|
341452 |
127264145 |
2 |
NF2H4C5 |
AB2C4D5 |
-170.73 |
6.57 |
-9.15 |
-0.73 |
0 |
|
|
341453 |
127264146 |
1 |
ClN2F3H8C10 |
AB2C3D8E10 |
-132.94 |
6.53 |
-9.11 |
-0.74 |
0 |
|
|
341454 |
127264147 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-162.71 |
7.0 |
-8.52 |
-0.48 |
0 |
|
|
341455 |
127264148 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-164.99 |
6.72 |
-8.63 |
-0.33 |
0 |
|
|
341456 |
127264149 |
1 |
ON2F6H8C11 |
AB2C6D8E11 |
-326.74 |
7.21 |
-9.35 |
-0.96 |
0 |
|
|
341457 |
127264150 |
1 |
N2F6H8C11 |
A2B6C8D11 |
-286.16 |
7.5 |
-9.43 |
-0.95 |
0 |
|
|
341458 |
127264151 |
1 |
BrN2F3H8C10 |
AB2C3D8E10 |
-121.04 |
6.4 |
-9.17 |
-0.75 |
0 |
|
|
341459 |
127264152 |
2 |
NF2H4C5 |
AB2C4D5 |
-171.53 |
4.96 |
-9.16 |
-0.68 |
0 |
|
|
341460 |
127264153 |
1 |
BrN2F3H8C10 |
AB2C3D8E10 |
-121.14 |
5.14 |
-9.17 |
-0.77 |
0 |
|
|
341461 |
127264154 |
2 |
NF2H4C5 |
AB2C4D5 |
-168.87 |
4.46 |
-9.0 |
-0.57 |
0 |
|
|
341462 |
127264155 |
1 |
ON2F6H8C11 |
AB2C6D8E11 |
-326.8 |
5.33 |
-9.2 |
-0.81 |
0 |
|
|
341463 |
127264156 |
1 |
N2F6H8C11 |
A2B6C8D11 |
-284.65 |
5.97 |
-9.29 |
-0.8 |
0 |
|
|
341464 |
127264157 |
2 |
NF2H4C5 |
AB2C4D5 |
-169.78 |
3.14 |
-9.01 |
-0.52 |
0 |
|
|
341465 |
127264158 |
1 |
BrN2F3H8C10 |
AB2C3D8E10 |
-119.36 |
3.36 |
-9.02 |
-0.62 |
0 |
|
|
341466 |
127264159 |
1 |
BrN2F3H8C10 |
AB2C3D8E10 |
-121.62 |
1.96 |
-8.96 |
-0.59 |
0 |
|
|
341467 |
127264160 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-164.2 |
1.79 |
-8.45 |
-0.24 |
0 |
|
|
341468 |
127264161 |
1 |
ON2F3C11H11 |
AB2C3D11E11 |
-162.26 |
4.24 |
-8.37 |
-0.33 |
0 |
|
|
341469 |
127264162 |
1 |
Cl2N3C7H9 |
A2B3C7D9 |
-1.86 |
6.63 |
-10.46 |
-1.2 |
0 |
|
|
341470 |
127264163 |
1 |
ClNOF2C3H8 |
ABCD2E3F8 |
-187.66 |
1.71 |
-9.95 |
1.87 |
0 |
|
|
341471 |
127264164 |
1 |
NOF2C3H7 |
ABC2D3E7 |
-155.78 |
1.47 |
-10.06 |
1.87 |
0 |
|
|
341472 |
127264165 |
1 |
NF2O3C8H15 |
AB2C3D8E15 |
-270.93 |
4.69 |
-10.34 |
0.21 |
0 |
|
|
341473 |
127264166 |
1 |
ClNOF2C3H8 |
ABCD2E3F8 |
-187.47 |
2.86 |
-10.18 |
1.81 |
0 |
|
|
341474 |
127264167 |
1 |
NOF2C3H7 |
ABC2D3E7 |
-155.57 |
0.98 |
-10.17 |
1.94 |
0 |
|
|
341475 |
127264168 |
1 |
NF2O3C8H15 |
AB2C3D8E15 |
-269.77 |
4.16 |
-10.32 |
0.22 |
0 |
|
|
341476 |
127264169 |
1 |
ClFNOC10H15 |
ABCDE10F15 |
-104.01 |
3.81 |
-9.61 |
-0.04 |
0 |
|
|
341477 |
127264170 |
1 |
BrNO2C16H22 |
ABC2D16E22 |
-100.31 |
1.77 |
-8.84 |
-0.04 |
0 |
|
|
341478 |
127264171 |
1 |
BrClON2C9H14 |
ABCD2E9F14 |
-53.8 |
2.99 |
-9.26 |
-0.16 |
0 |
|
|
341479 |
127264172 |
1 |
ClNO2C9H10 |
ABC2D9E10 |
-77.85 |
1.09 |
-9.95 |
-1.1 |
0 |
|
|
341480 |
127264173 |
1 |
ON2F6H6C9 |
AB2C6D6E9 |
-297.26 |
2.48 |
-9.53 |
-1.49 |
0 |
|
|
341481 |
127264174 |
1 |
ON2F3C9H9 |
AB2C3D9E9 |
-147.08 |
3.68 |
-9.2 |
-0.7 |
0 |
|
|
341482 |
127264175 |
1 |
NF2O4C6H7 |
AB2C4D6E7 |
-210.52 |
4.32 |
-10.68 |
-1.3 |
0 |
|
|
341483 |
127264176 |
1 |
ClNC12H18 |
ABC12D18 |
-27.59 |
2.96 |
-9.27 |
0.28 |
0 |
|
|
341484 |
127264177 |
1 |
BrClNC11H15 |
ABCD11E15 |
-15.93 |
2.17 |
-9.65 |
-0.23 |
0 |
|
|
341485 |
127264178 |
1 |
ClNOC12H18 |
ABCD12E18 |
-58.73 |
2.76 |
-8.81 |
0.26 |
0 |
|
|
341486 |
127264179 |
1 |
ClNOC12H18 |
ABCD12E18 |
-58.59 |
3.56 |
-8.84 |
0.2 |
0 |
|
|
341487 |
127264180 |
1 |
BrClNC11H15 |
ABCD11E15 |
-15.87 |
4.25 |
-9.51 |
-0.18 |
0 |
|
|
341488 |
127264181 |
1 |
ClFNC11H15 |
ABCD11E15 |
-65.93 |
1.26 |
-9.67 |
-0.1 |
0 |
|
|
341489 |
127264182 |
1 |
N4O4C13H18 |
A4B4C13D18 |
-153.3 |
6.85 |
-9.76 |
-0.02 |
0 |
|
|
341490 |
127264183 |
1 |
OSiN4C11H20 |
ABC4D11E20 |
-12.43 |
2.51 |
-9.75 |
0.34 |
0 |
|
|
341491 |
127264184 |
1 |
SiO3N4C12H20 |
AB3C4D12E20 |
-122.3 |
3.82 |
-9.91 |
-0.05 |
0 |
|
|
341492 |
127264185 |
1 |
SiN2O2C15H20 |
AB2C2D15E20 |
-105.22 |
4.81 |
-9.09 |
-0.27 |
0 |
|
|
341493 |
127264186 |
1 |
NOSF3C10H18 |
ABCD3E10F18 |
-213.43 |
2.37 |
-8.74 |
0.18 |
0 |
|
|
341494 |
127264187 |
1 |
ClNF3C6H11 |
ABC3D6E11 |
-201.65 |
0.18 |
-10.14 |
1.36 |
0 |
|
|
341495 |
127264188 |
1 |
NF4C13H15 |
AB4C13D15 |
-187.96 |
1.87 |
-9.6 |
-0.22 |
0 |
|
|
341496 |
127264189 |
1 |
NOSF3C10H18 |
ABCD3E10F18 |
-213.25 |
2.22 |
-8.74 |
0.16 |
0 |
|
|
341497 |
127264190 |
1 |
ClNF3C6H11 |
ABC3D6E11 |
-198.84 |
3.54 |
-10.12 |
1.51 |
0 |
|
|
341498 |
127264191 |
1 |
NF4C13H15 |
AB4C13D15 |
-188.16 |
4.22 |
-9.68 |
-0.22 |
0 |
|
|
341499 |
127264192 |
1 |
ClNOF3C7H13 |
ABCD3E7F13 |
-250.69 |
4.18 |
-9.94 |
1.53 |
0 |
|
|
341500 |
127264193 |
1 |
ClNOF3C7H13 |
ABCD3E7F13 |
-252.95 |
1.89 |
-9.79 |
1.27 |
0 |
|
|
341501 |
127264194 |
1 |
ClNO2C12H18 |
ABC2D12E18 |
-103.51 |
3.23 |
-8.92 |
0.07 |
0 |
|
|
341502 |
127264195 |
1 |
NO2C12H17 |
AB2C12D17 |
-70.32 |
3.45 |
-9.07 |
0.2 |
0 |
|
|
341503 |
127264196 |
1 |
N3C15H17 |
A3B15C17 |
61.21 |
2.66 |
-8.45 |
-0.31 |
0 |
|
|
341504 |
127264197 |
1 |
BrClNC9H13 |
ABCD9E13 |
-32.62 |
3.26 |
-10.32 |
-0.77 |
0 |
|
|
341505 |
127264198 |
1 |
ClNSO2C8H10 |
ABCD2E8F10 |
-74.31 |
7.61 |
-9.6 |
-1.03 |
0 |
|
|
341506 |
127264199 |
1 |
BrClNOC12H15 |
ABCDE12F15 |
-59.93 |
2.5 |
-8.75 |
-0.33 |
0 |
|
|
341507 |
127264200 |
1 |
BrClNSH7C8 |
ABCDE7F8 |
5.06 |
3.55 |
-8.79 |
-0.65 |
0 |
|
|
341508 |
127264201 |
1 |
ClNF2C6H10 |
ABC2D6E10 |
-134.0 |
4.33 |
-9.41 |
1.7 |
0 |