List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
282500 |
103928940 |
1 |
ON6C13H18 |
AB6C13D18 |
37.48 |
3.98 |
-9.11 |
-0.89 |
0 |
|
|
282501 |
103928942 |
1 |
ON2C16H26 |
AB2C16D26 |
-71.87 |
3.49 |
-9.0 |
0.19 |
0 |
|
|
282502 |
103928947 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-128.17 |
3.27 |
-8.49 |
-0.43 |
0 |
|
|
282503 |
103928949 |
1 |
ON3C17H27 |
AB3C17D27 |
-50.54 |
4.87 |
-8.66 |
0.13 |
0 |
|
|
282504 |
103928952 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-123.12 |
3.18 |
-8.4 |
-0.01 |
0 |
|
|
282505 |
103928959 |
1 |
N2O2C17H28 |
A2B2C17D28 |
-105.24 |
3.88 |
-9.34 |
0.0 |
0 |
|
|
282506 |
103928964 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-33.4 |
4.85 |
-9.3 |
-1.12 |
0 |
|
|
282507 |
103928966 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-100.76 |
2.62 |
-8.65 |
-0.02 |
0 |
|
|
282508 |
103928969 |
1 |
ClO2N3C13H18 |
AB2C3D13E18 |
-95.08 |
6.02 |
-9.49 |
-0.77 |
0 |
|
|
282509 |
103928970 |
1 |
OBr2N2C12H16 |
AB2C2D12E16 |
-41.48 |
2.84 |
-9.33 |
-0.71 |
0 |
|
|
282510 |
103928972 |
1 |
BrOSN3C9H14 |
ABCD3E9F14 |
-12.72 |
3.55 |
-9.32 |
-0.93 |
0 |
|
|
282511 |
103928973 |
1 |
BrON2F3C13H16 |
ABC2D3E13F16 |
-200.58 |
2.27 |
-9.5 |
-1.03 |
0 |
|
|
282512 |
103928980 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-89.83 |
3.4 |
-9.01 |
0.12 |
0 |
|
|
282513 |
103928983 |
1 |
ON3C13H21 |
AB3C13D21 |
-40.95 |
2.12 |
-9.54 |
-0.23 |
0 |
|
|
282514 |
103928984 |
1 |
ON3C14H23 |
AB3C14D23 |
-39.99 |
4.42 |
-9.43 |
-0.14 |
0 |
|
|
282515 |
103928985 |
1 |
N2O2C11H22 |
A2B2C11D22 |
-117.48 |
3.58 |
-9.56 |
0.81 |
0 |
|
|
282516 |
103928988 |
1 |
SN2O3C9H20 |
AB2C3D9E20 |
-156.81 |
6.83 |
-9.62 |
0.68 |
0 |
|
|
282517 |
103928989 |
1 |
FON3C16H24 |
ABC3D16E24 |
-80.43 |
4.1 |
-9.12 |
-0.25 |
0 |
|
|
282518 |
103928991 |
1 |
O2N3C13H27 |
A2B3C13D27 |
-130.54 |
7.14 |
-9.44 |
0.96 |
0 |
|
|
282519 |
103928993 |
1 |
ON4C13H28 |
AB4C13D28 |
-69.81 |
3.4 |
-8.27 |
0.96 |
0 |
|
|
282520 |
103929067 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-79.67 |
4.08 |
-8.34 |
-0.04 |
0 |
|
|
282521 |
103929086 |
3 |
NOC5H9 |
ABC5D9 |
-153.79 |
4.49 |
-9.22 |
0.66 |
0 |
|
|
282522 |
103929093 |
1 |
O2N3C15H29 |
A2B3C15D29 |
-116.15 |
2.86 |
-8.84 |
0.82 |
0 |
|
|
282523 |
103929095 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-81.29 |
3.16 |
-9.38 |
0.0 |
0 |
|
|
282524 |
103929133 |
1 |
FN2O2C15H23 |
AB2C2D15E23 |
-129.07 |
3.37 |
-9.06 |
-0.29 |
0 |
|
|
282525 |
103929187 |
1 |
OCl2N2C15H22 |
AB2C2D15E22 |
-66.64 |
4.59 |
-9.46 |
-0.46 |
0 |
|
|
282526 |
103929232 |
2 |
NOC8H13 |
ABC8D13 |
-87.83 |
2.59 |
-8.9 |
0.23 |
0 |
|
|
282527 |
103929270 |
1 |
ON2C18H38 |
AB2C18D38 |
-120.13 |
3.96 |
-9.25 |
1.17 |
0 |
|
|
282528 |
103929600 |
1 |
ON3C15H31 |
AB3C15D31 |
-107.92 |
2.54 |
-8.93 |
1.06 |
0 |
|
|
282529 |
103929637 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-91.53 |
5.15 |
-8.67 |
0.02 |
0 |
|
|
282530 |
103929647 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-133.62 |
2.8 |
-9.54 |
0.12 |
0 |
|
|
282531 |
103929654 |
1 |
ClF2N2O2C13H17 |
AB2C2D2E13F17 |
-199.9 |
3.56 |
-9.19 |
-0.62 |
0 |
|
|
282532 |
103929785 |
1 |
ON3C13H29 |
AB3C13D29 |
-90.92 |
3.69 |
-8.69 |
1.08 |
0 |
|
|
282533 |
103929902 |
1 |
OSN3C12H21 |
ABC3D12E21 |
-47.76 |
2.55 |
-9.18 |
-0.39 |
0 |
|
|
282534 |
103929907 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-41.35 |
3.24 |
-9.4 |
-0.67 |
0 |
|
|
282535 |
103930000 |
1 |
O2N3C14H29 |
A2B3C14D29 |
-129.07 |
3.88 |
-8.72 |
0.91 |
0 |
|
|
282536 |
103930005 |
1 |
N2O3C14H28 |
A2B3C14D28 |
-182.98 |
6.55 |
-9.5 |
0.52 |
0 |
|
|
282537 |
103930033 |
2 |
NOC6H12 |
ABC6D12 |
-114.79 |
3.25 |
-9.26 |
0.95 |
0 |
|
|
282538 |
103930098 |
1 |
N2O3C11H22 |
A2B3C11D22 |
-170.48 |
3.97 |
-9.9 |
0.28 |
0 |
|
|
282539 |
103930153 |
1 |
ON3C12H21 |
AB3C12D21 |
-32.23 |
3.59 |
-8.4 |
0.22 |
0 |
|
|
282540 |
103930203 |
2 |
NO2C6H9 |
AB2C6D9 |
-155.5 |
4.79 |
-9.78 |
-1.01 |
0 |
|
|
282541 |
103930322 |
1 |
ON2C13H26 |
AB2C13D26 |
-95.23 |
2.63 |
-9.53 |
1.28 |
0 |
|
|
282542 |
103930325 |
1 |
ON2C15H30 |
AB2C15D30 |
-102.35 |
2.71 |
-9.52 |
1.3 |
0 |
|
|
282543 |
103930360 |
1 |
BrON2C13H19 |
ABC2D13E19 |
-54.83 |
2.19 |
-9.03 |
-0.26 |
0 |
|
|
282544 |
103930398 |
1 |
ON2C11H20 |
AB2C11D20 |
-18.1 |
3.51 |
-9.39 |
0.84 |
0 |
|
|
282545 |
103930432 |
1 |
N2O5C14H26 |
A2B5C14D26 |
-271.51 |
4.53 |
-9.82 |
0.33 |
0 |
|
|
282546 |
103930440 |
2 |
NOC6H13 |
ABC6D13 |
-124.68 |
3.54 |
-9.27 |
1.15 |
0 |
|
|
282547 |
103930506 |
1 |
N4C15H16 |
A4B15C16 |
86.09 |
3.6 |
-8.37 |
-0.5 |
0 |
|
|
282548 |
103930512 |
1 |
BrClN2O2H12C13 |
ABC2D2E12F13 |
-23.46 |
7.38 |
-8.77 |
-0.65 |
0 |
|
|
282549 |
103930547 |
1 |
BrClN4C10H10 |
ABC4D10E10 |
66.11 |
5.38 |
-8.94 |
-0.72 |
0 |
|
|
282550 |
103930569 |
1 |
BrClN2O2C14H14 |
ABC2D2E14F14 |
-16.56 |
8.82 |
-8.57 |
-0.53 |
0 |
|
|
282551 |
103930616 |
1 |
ON3C17H19 |
AB3C17D19 |
18.67 |
3.6 |
-8.55 |
-0.16 |
0 |
|
|
282552 |
103930652 |
1 |
FNOC17H24 |
ABCD17E24 |
-77.29 |
3.82 |
-9.22 |
-0.16 |
0 |
|
|
282553 |
103930665 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-101.36 |
5.47 |
-8.28 |
0.35 |
0 |
|
|
282554 |
103930677 |
1 |
ON2C15H30 |
AB2C15D30 |
-53.13 |
3.66 |
-8.82 |
2.35 |
0 |
|
|
282555 |
103930700 |
1 |
NO2C15H29 |
AB2C15D29 |
-135.77 |
1.8 |
-8.88 |
2.35 |
0 |
|
|
282556 |
103930771 |
1 |
NOC13H27 |
ABC13D27 |
-90.72 |
2.95 |
-8.92 |
2.66 |
0 |
|
|
282557 |
103930880 |
1 |
SO2N3C9H17 |
AB2C3D9E17 |
-61.33 |
6.26 |
-9.35 |
-0.08 |
0 |
|
|
282558 |
103930882 |
1 |
NO3C15H25 |
AB3C15D25 |
-119.42 |
5.26 |
-8.01 |
0.69 |
0 |
|
|
282559 |
103930889 |
1 |
ClON2C17H19 |
ABC2D17E19 |
-31.1 |
3.25 |
-8.36 |
-0.09 |
0 |
|
|
282560 |
103931109 |
1 |
BrON2C11H15 |
ABC2D11E15 |
-18.54 |
3.16 |
-8.71 |
-0.46 |
0 |
|
|
282561 |
103931120 |
1 |
OF2N2C13H14 |
AB2C2D13E14 |
-85.39 |
3.24 |
-8.86 |
-1.19 |
0 |
|
|
282562 |
103931122 |
1 |
ON3C12H15 |
AB3C12D15 |
11.3 |
5.03 |
-8.94 |
-0.88 |
0 |
|
|
282563 |
103931136 |
1 |
ON2C16H26 |
AB2C16D26 |
-65.31 |
5.43 |
-8.26 |
0.3 |
0 |
|
|
282564 |
103931146 |
1 |
ON2C16H26 |
AB2C16D26 |
-53.08 |
2.13 |
-7.99 |
0.62 |
0 |
|
|
282565 |
103931175 |
1 |
F2N2C17H20 |
A2B2C17D20 |
-52.33 |
1.05 |
-8.23 |
-0.45 |
0 |
|
|
282566 |
103931214 |
1 |
BrFNO2C10H13 |
ABCD2E10F13 |
-117.6 |
2.28 |
-8.75 |
-0.16 |
0 |
|
|
282567 |
103931244 |
1 |
ClNSO3C14H22 |
ABCD3E14F22 |
-148.75 |
5.36 |
-9.7 |
-0.61 |
0 |
|
|
282568 |
103931250 |
1 |
NSO5C10H21 |
ABC5D10E21 |
-253.43 |
3.36 |
-10.17 |
0.02 |
0 |
|
|
282569 |
103931252 |
1 |
SN2O5C11H24 |
AB2C5D11E24 |
-242.12 |
4.44 |
-9.76 |
-0.21 |
0 |
|
|
282570 |
103931270 |
1 |
SN2O4C11H20 |
AB2C4D11E20 |
-147.04 |
5.27 |
-9.98 |
-0.07 |
0 |
|
|
282571 |
103931441 |
1 |
NO2C12H25 |
AB2C12D25 |
-113.07 |
1.67 |
-9.05 |
2.18 |
0 |
|
|
282572 |
103931442 |
1 |
BrNOSC11H14 |
ABCDE11F14 |
-18.42 |
3.88 |
-8.93 |
-0.68 |
0 |
|
|
282573 |
103931465 |
1 |
OS2N3C15H17 |
AB2C3D15E17 |
69.33 |
2.04 |
-8.85 |
-0.39 |
0 |
|
|
282574 |
103931466 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-12.51 |
2.31 |
-9.17 |
-0.33 |
0 |
|
|
282575 |
103931467 |
1 |
ON4C14H16 |
AB4C14D16 |
62.4 |
5.85 |
-9.44 |
-0.64 |
0 |
|
|
282576 |
103931468 |
1 |
SN3O3C9H17 |
AB3C3D9E17 |
-83.52 |
4.76 |
-9.44 |
-0.39 |
0 |
|
|
282577 |
103931530 |
1 |
ON5C14H23 |
AB5C14D23 |
21.96 |
4.04 |
-8.86 |
-0.19 |
0 |
|
|
282578 |
103931581 |
1 |
ON3C11H21 |
AB3C11D21 |
-14.75 |
0.81 |
-9.04 |
-0.15 |
0 |
|
|
282579 |
103931595 |
1 |
FON4C12H15 |
ABC4D12E15 |
-5.79 |
2.78 |
-9.39 |
-0.4 |
0 |
|
|
282580 |
103931600 |
1 |
N2O2C11H20 |
A2B2C11D20 |
-101.62 |
3.25 |
-9.15 |
0.99 |
0 |
|
|
282581 |
103931601 |
1 |
ON3C17H25 |
AB3C17D25 |
6.68 |
3.72 |
-9.02 |
-0.19 |
0 |
|
|
282582 |
103931603 |
1 |
ON3C10H19 |
AB3C10D19 |
-7.02 |
1.49 |
-8.97 |
-0.23 |
0 |
|
|
282583 |
103931771 |
1 |
SN2O3C11H24 |
AB2C3D11E24 |
-158.1 |
5.59 |
-9.16 |
0.63 |
0 |
|
|
282584 |
103931855 |
1 |
FNOC17H24 |
ABCD17E24 |
-83.28 |
1.95 |
-9.12 |
-0.03 |
0 |
|
|
282585 |
103931866 |
1 |
BrFON2C14H20 |
ABCD2E14F20 |
-90.7 |
4.29 |
-9.4 |
-0.73 |
0 |
|
|
282586 |
103931929 |
1 |
BrFON2H14C16 |
ABCD2E14F16 |
-12.4 |
5.32 |
-8.2 |
-0.59 |
0 |
|
|
282587 |
103931938 |
1 |
Br2N3O3H7C12 |
A2B3C3D7E12 |
10.8 |
9.32 |
-9.78 |
-1.76 |
0 |
|
|
282588 |
103932033 |
1 |
OSN2C10H16 |
ABC2D10E16 |
-25.92 |
3.35 |
-8.98 |
-0.16 |
0 |
|
|
282589 |
103932069 |
1 |
BrON4C10H17 |
ABC4D10E17 |
-10.9 |
6.42 |
-9.14 |
0.27 |
0 |
|
|
282590 |
103932102 |
1 |
F2N3C15H17 |
A2B3C15D17 |
-38.65 |
1.02 |
-8.02 |
-0.46 |
0 |
|
|
282591 |
103932106 |
2 |
NOC7H11 |
ABC7D11 |
-81.51 |
3.18 |
-8.38 |
0.46 |
0 |
|
|
282592 |
103932107 |
1 |
ON2C16H18 |
AB2C16D18 |
-4.21 |
1.39 |
-8.56 |
0.32 |
0 |
|
|
282593 |
103932141 |
1 |
ON2C13H22 |
AB2C13D22 |
-40.53 |
0.88 |
-8.12 |
0.0 |
0 |
|
|
282594 |
103932222 |
1 |
ON2C17H28 |
AB2C17D28 |
-58.34 |
3.39 |
-8.26 |
0.29 |
0 |
|
|
282595 |
103932275 |
1 |
ON2C16H20 |
AB2C16D20 |
-5.74 |
5.71 |
-8.28 |
0.02 |
0 |
|
|
282596 |
103932299 |
1 |
ON2C17H20 |
AB2C17D20 |
-7.15 |
5.48 |
-8.33 |
0.2 |
0 |
|
|
282597 |
103932353 |
2 |
NOC8H9 |
ABC8D9 |
-32.47 |
5.26 |
-8.43 |
-0.09 |
0 |
|
|
282598 |
103932354 |
1 |
IN2C14H15 |
AB2C14D15 |
57.88 |
2.99 |
-8.66 |
-0.92 |
0 |
|
|
282599 |
103932474 |
1 |
ON3C16H23 |
AB3C16D23 |
5.5 |
1.14 |
-7.91 |
0.38 |
0 |