List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
322531 |
126670412 |
1 |
N5C17H23 |
A5B17C23 |
47.03 |
4.2 |
-8.26 |
-0.32 |
0 |
|
|
322532 |
126670413 |
1 |
N2F3O3C21H31 |
A2B3C3D21E31 |
-296.29 |
4.06 |
-9.51 |
0.67 |
0 |
|
|
322533 |
126670418 |
1 |
ClO3N4H17C18 |
AB3C4D17E18 |
-34.72 |
8.97 |
-8.97 |
-1.05 |
0 |
|
|
322534 |
126670421 |
1 |
N7O32C61H109 |
A7B32C61D109 |
-1480.34 |
7.5 |
-9.22 |
-0.11 |
0 |
|
|
322536 |
126670423 |
1 |
NPO8C14H24 |
ABC8D14E24 |
-406.57 |
6.61 |
-9.41 |
-0.7 |
0 |
|
|
322538 |
126670427 |
1 |
ON4H35C38 |
AB4C35D38 |
136.7 |
3.59 |
0.0 |
0.0 |
0 |
|
|
322539 |
126670433 |
1 |
FO2N7C27H30 |
AB2C7D27E30 |
9.18 |
4.48 |
-8.0 |
-0.68 |
0 |
|
|
322540 |
126670438 |
1 |
SO2N7C26H31 |
AB2C7D26E31 |
91.99 |
6.24 |
-7.66 |
-0.42 |
0 |
|
|
322541 |
126670446 |
1 |
O2N8C29H36 |
A2B8C29D36 |
24.78 |
3.79 |
-8.51 |
-0.59 |
0 |
|
|
322542 |
126670447 |
1 |
O6N8C49H52 |
A6B8C49D52 |
-131.44 |
2.52 |
-8.72 |
-0.63 |
0 |
|
|
322543 |
126670449 |
1 |
O3N9C32H43 |
A3B9C32D43 |
-9.78 |
6.99 |
-7.71 |
-0.39 |
0 |
|
|
322544 |
126670454 |
2 |
O2H15C16 |
A2B15C16 |
-11.1 |
2.1 |
-8.1 |
-0.76 |
0 |
|
|
322545 |
126670461 |
1 |
SC13H26 |
AB13C26 |
33.39 |
1.07 |
-6.2 |
0.66 |
0 |
|
|
322546 |
126670464 |
1 |
O8C21H22 |
A8B21C22 |
-284.42 |
14.36 |
-9.86 |
-1.27 |
0 |
|
|
322547 |
126670466 |
1 |
N2C13H18 |
A2B13C18 |
48.53 |
4.0 |
-8.58 |
-0.12 |
0 |
|
|
322548 |
126670468 |
1 |
ClON3C16H18 |
ABC3D16E18 |
1.8 |
2.96 |
-8.43 |
-0.49 |
0 |
|
|
322549 |
126670477 |
1 |
OSN2H14C20 |
ABC2D14E20 |
46.89 |
2.86 |
-8.21 |
-1.1 |
0 |
|
|
322550 |
126670483 |
1 |
NPO2H24C27 |
ABC2D24E27 |
-21.44 |
4.1 |
-8.31 |
-0.58 |
0 |
|
|
322551 |
126670488 |
2 |
FOC9H11 |
ABC9D11 |
-186.33 |
2.18 |
-9.65 |
-0.12 |
0 |
|
|
322552 |
126670491 |
1 |
NO4C24H31 |
AB4C24D31 |
-185.39 |
0.77 |
-9.26 |
0.2 |
0 |
|
|
322553 |
126670493 |
1 |
N2O2C17H18 |
A2B2C17D18 |
41.98 |
6.61 |
-9.02 |
-1.43 |
0 |
|
|
322554 |
126670496 |
1 |
NC14H19 |
AB14C19 |
44.45 |
1.75 |
-8.07 |
0.58 |
0 |
|
|
322555 |
126670497 |
1 |
N2C21H26 |
A2B21C26 |
53.42 |
2.98 |
-7.92 |
0.34 |
0 |
|
|
322556 |
126670500 |
1 |
O4N9C28H33 |
A4B9C28D33 |
-35.89 |
8.45 |
-8.12 |
-0.81 |
0 |
|
|
322557 |
126670501 |
2 |
O2N4C14H17 |
A2B4C14D17 |
-40.72 |
4.61 |
-8.0 |
-0.63 |
0 |
|
|
322558 |
126670502 |
1 |
FO3N8C28H33 |
AB3C8D28E33 |
-50.27 |
4.85 |
-8.45 |
-0.59 |
0 |
|
|
322559 |
126670504 |
2 |
ON4C15H18 |
AB4C15D18 |
60.73 |
2.43 |
-8.16 |
-0.61 |
0 |
|
|
322560 |
126670507 |
1 |
O4N9C29H35 |
A4B9C29D35 |
-41.82 |
5.63 |
-7.97 |
-0.8 |
0 |
|
|
322561 |
126670508 |
1 |
O2N7C30H35 |
A2B7C30D35 |
45.61 |
8.17 |
-7.92 |
-0.43 |
0 |
|
|
322562 |
126670509 |
1 |
N3C7H15 |
A3B7C15 |
10.44 |
2.6 |
-8.17 |
1.0 |
0 |
|
|
322563 |
126670510 |
1 |
N2C7H12 |
A2B7C12 |
11.97 |
1.94 |
-8.44 |
1.28 |
0 |
|
|
322564 |
126670511 |
1 |
NOC7H11 |
ABC7D11 |
-26.17 |
1.75 |
-8.34 |
0.67 |
0 |
|
|
322565 |
126670520 |
1 |
ON2H20C22 |
AB2C20D22 |
33.69 |
2.72 |
-7.83 |
-0.28 |
0 |
|
|
322566 |
126670534 |
1 |
SO2N5C32H41 |
AB2C5D32E41 |
-25.12 |
6.65 |
-8.75 |
-0.24 |
0 |
|
|
322567 |
126670547 |
1 |
N3H37C45 |
A3B37C45 |
170.15 |
1.31 |
-7.98 |
-0.37 |
0 |
|
|
322568 |
126670548 |
1 |
NSO6C15H27 |
ABC6D15E27 |
-301.08 |
4.07 |
-8.89 |
-0.47 |
0 |
|
|
322569 |
126670549 |
1 |
NO6C15H27 |
AB6C15D27 |
-312.88 |
1.3 |
-9.89 |
0.24 |
0 |
|
|
322570 |
126670550 |
1 |
FNO5C15H26 |
ABC5D15E26 |
-317.14 |
0.61 |
-9.94 |
0.19 |
0 |
|
|
322571 |
126670551 |
1 |
O3N4C14H20 |
A3B4C14D20 |
-50.1 |
5.64 |
-9.35 |
-0.88 |
0 |
|
|
322572 |
126670552 |
1 |
N3O3S7C95H143 |
A3B3C7D95E143 |
-224.0 |
4.39 |
-8.13 |
-1.71 |
0 |
|
|
322573 |
126670553 |
1 |
OF3N3C12H20 |
AB3C3D12E20 |
-221.82 |
4.0 |
-9.57 |
0.62 |
0 |
|
|
322574 |
126670554 |
1 |
BrN2H17C19 |
AB2C17D19 |
77.19 |
3.16 |
-8.57 |
-0.4 |
0 |
|
|
322575 |
126670556 |
1 |
ON4H34C41 |
AB4C34D41 |
111.55 |
1.67 |
-8.09 |
-0.55 |
0 |
|
|
322576 |
126670557 |
1 |
O3N4C16H16 |
A3B4C16D16 |
-43.62 |
1.48 |
-9.32 |
-1.0 |
0 |
|
|
322577 |
126670559 |
1 |
FNO3C10H18 |
ABC3D10E18 |
-190.5 |
3.07 |
-9.74 |
0.83 |
0 |
|
|
322578 |
126670560 |
1 |
NO5C17H21 |
AB5C17D21 |
-159.86 |
1.72 |
-9.86 |
-0.31 |
0 |
|
|
322579 |
126670561 |
1 |
FNO5C15H26 |
ABC5D15E26 |
-304.01 |
4.5 |
-9.85 |
0.32 |
0 |
|
|
322580 |
126670562 |
2 |
O3N4C17H23 |
A3B4C17D23 |
-132.18 |
1.94 |
-8.72 |
-0.81 |
0 |
|
|
322581 |
126670563 |
1 |
FNO5C17H22 |
ABC5D17E22 |
-256.52 |
4.3 |
-9.8 |
-0.26 |
0 |
|
|
322582 |
126670564 |
1 |
FNO3C13H16 |
ABC3D13E16 |
-155.31 |
3.33 |
-9.38 |
-0.09 |
0 |
|
|
322583 |
126670565 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-151.82 |
2.54 |
-9.2 |
-0.12 |
0 |
|
|
322584 |
126670566 |
1 |
BrFO2N3C11H13 |
ABC2D3E11F13 |
-108.31 |
3.8 |
-9.57 |
-0.8 |
0 |
|
|
322585 |
126670567 |
1 |
BrFN3O4C16H21 |
ABC3D4E16F21 |
-225.44 |
5.86 |
-9.26 |
-0.49 |
0 |
|
|
322586 |
126670570 |
1 |
NO4C16H29 |
AB4C16D29 |
-231.53 |
4.76 |
-9.5 |
0.62 |
0 |
|
|
322587 |
126670571 |
1 |
NO4C15H25 |
AB4C15D25 |
-193.8 |
4.38 |
-9.71 |
0.46 |
0 |
|
|
322588 |
126670572 |
1 |
BrN3O3C17H24 |
AB3C3D17E24 |
-137.93 |
3.62 |
-9.26 |
-0.48 |
0 |
|
|
322589 |
126670573 |
1 |
O4N7C45H49 |
A4B7C45D49 |
-20.81 |
7.8 |
-8.44 |
-0.37 |
0 |
|
|
322590 |
126670576 |
1 |
N5O7C39H65 |
A5B7C39D65 |
-366.78 |
5.38 |
-9.21 |
0.18 |
0 |
|
|
322591 |
126670577 |
1 |
NOC13H13 |
ABC13D13 |
14.01 |
1.8 |
-8.9 |
-0.16 |
0 |
|
|
322592 |
126670579 |
1 |
FSO3N6H27C34 |
ABC3D6E27F34 |
-2.35 |
12.7 |
-8.87 |
-1.56 |
0 |
|
|
322593 |
126670607 |
1 |
SN3C5H11 |
AB3C5D11 |
16.47 |
3.83 |
-8.5 |
-0.03 |
0 |
|
|
322594 |
126670609 |
1 |
C4N5H9 |
A4B5C9 |
80.14 |
5.52 |
-11.06 |
-0.33 |
0 |
|
|
322595 |
126670611 |
1 |
NC13H21 |
AB13C21 |
17.48 |
2.65 |
-7.44 |
0.34 |
0 |
|
|
322596 |
126670612 |
1 |
ClFO4N5H27C35 |
ABC4D5E27F35 |
-44.85 |
5.79 |
-9.22 |
-1.2 |
0 |
|
|
322597 |
126670613 |
1 |
N3H27C31 |
A3B27C31 |
112.4 |
1.04 |
-7.87 |
-0.2 |
0 |
|
|
322598 |
126670616 |
1 |
N2F3O3C20H31 |
A2B3C3D20E31 |
-286.52 |
4.91 |
-8.51 |
0.44 |
0 |
|
|
322599 |
126670618 |
1 |
O4C17H20 |
A4B17C20 |
-32.22 |
3.85 |
-9.82 |
-0.13 |
0 |
|
|
322600 |
126670623 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-48.12 |
5.97 |
-8.05 |
-0.61 |
0 |
|
|
322601 |
126670624 |
1 |
OPN2C19H27 |
ABC2D19E27 |
-66.88 |
5.92 |
-7.93 |
-0.12 |
0 |
|
|
322602 |
126670626 |
1 |
N2F3O4C16H23 |
A2B3C4D16E23 |
-315.45 |
10.47 |
-9.1 |
0.14 |
0 |
|
|
322603 |
126670628 |
1 |
NSO2F3C12H16 |
ABC2D3E12F16 |
-261.91 |
6.11 |
-8.95 |
0.23 |
0 |
|
|
322604 |
126670632 |
1 |
N2F3O3C19H31 |
A2B3C3D19E31 |
-335.56 |
6.11 |
-9.45 |
0.56 |
0 |
|
|
322605 |
126670633 |
1 |
NOC10H17 |
ABC10D17 |
32.04 |
1.92 |
-8.4 |
2.41 |
0 |
|
|
322606 |
126670634 |
1 |
NO2C55H101 |
AB2C55D101 |
-281.04 |
4.69 |
-8.82 |
0.07 |
0 |
|
|
322607 |
126670641 |
1 |
N2C13H28 |
A2B13C28 |
-40.23 |
1.07 |
-8.39 |
2.76 |
0 |
|
|
322608 |
126670644 |
1 |
ClOF2N2C17H17 |
ABC2D2E17F17 |
-81.37 |
2.3 |
-8.94 |
-0.3 |
0 |
|
|
322609 |
126670645 |
1 |
BrO3N7C29H30 |
AB3C7D29E30 |
-15.34 |
6.22 |
-9.07 |
-0.97 |
0 |
|
|
322610 |
126670646 |
1 |
ClFN2O3C23H24 |
ABC2D3E23F24 |
-141.99 |
5.23 |
-8.83 |
-0.26 |
0 |
|
|
322611 |
126670648 |
1 |
O2N8C29H36 |
A2B8C29D36 |
62.45 |
3.82 |
-8.03 |
-0.45 |
0 |
|
|
322612 |
126670649 |
1 |
O3N9C25H29 |
A3B9C25D29 |
55.48 |
7.43 |
-8.38 |
-1.13 |
0 |
|
|
322613 |
126670650 |
1 |
O3N9C26H31 |
A3B9C26D31 |
50.44 |
12.97 |
-8.61 |
-0.84 |
0 |
|
|
322614 |
126670653 |
1 |
O2N7C28H31 |
A2B7C28D31 |
57.45 |
2.41 |
-7.95 |
-0.58 |
0 |
|
|
322615 |
126670657 |
2 |
F2O2N3H13C15 |
A2B2C3D13E15 |
-237.14 |
8.28 |
-9.14 |
-1.03 |
0 |
|
|
322616 |
126670661 |
1 |
O4N9C32H39 |
A4B9C32D39 |
-39.3 |
7.6 |
-8.32 |
-0.63 |
0 |
|
|
322617 |
126670662 |
1 |
ON4H34C38 |
AB4C34D38 |
115.28 |
2.64 |
-8.37 |
-0.55 |
0 |
|
|
322618 |
126670663 |
1 |
BrSO3N7C27H28 |
ABC3D7E27F28 |
23.61 |
3.8 |
-7.97 |
-1.01 |
0 |
|
|
322619 |
126670665 |
1 |
BrO4N7C29H30 |
AB4C7D29E30 |
-55.57 |
3.73 |
-9.18 |
-1.04 |
0 |
|
|
322620 |
126670667 |
1 |
FNO5C15H26 |
ABC5D15E26 |
-296.79 |
4.82 |
-9.88 |
0.34 |
0 |
|
|
322621 |
126670668 |
1 |
NSF2O6C22H29 |
ABC2D6E22F29 |
-349.63 |
2.77 |
-9.43 |
-0.73 |
0 |
|
|
322622 |
126670669 |
1 |
FNO4C15H26 |
ABC4D15E26 |
-281.04 |
3.62 |
-9.91 |
0.24 |
0 |
|
|
322623 |
126670670 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-93.9 |
7.45 |
-8.3 |
-0.52 |
0 |
|
|
322624 |
126670671 |
1 |
ClN2O3C6H15 |
AB2C3D6E15 |
-118.09 |
4.75 |
-9.47 |
0.26 |
0 |
|
|
322625 |
126670687 |
1 |
O4N7C39H43 |
A4B7C39D43 |
-57.18 |
3.13 |
-8.5 |
-0.74 |
0 |
|
|
322626 |
126670688 |
1 |
SO3N7C37H39 |
AB3C7D37E39 |
61.66 |
3.52 |
-8.57 |
-1.11 |
0 |
|
|
322627 |
126670690 |
1 |
SO3N7C33H41 |
AB3C7D33E41 |
24.83 |
7.01 |
-8.53 |
-0.17 |
0 |
|
|
322628 |
126670691 |
1 |
O4N7C24H27 |
A4B7C24D27 |
-75.14 |
10.6 |
-9.21 |
-1.0 |
0 |
|
|
322629 |
126670692 |
1 |
O2N5C22H25 |
A2B5C22D25 |
5.73 |
6.6 |
-9.07 |
-0.98 |
0 |
|
|
322630 |
126670695 |
1 |
FIC10H10 |
ABC10D10 |
-9.06 |
2.76 |
-9.66 |
-0.73 |
0 |
|
|
322631 |
126670696 |
1 |
FSN2H9C10 |
ABC2D9E10 |
16.34 |
2.99 |
-9.61 |
-1.25 |
0 |
|
|
322632 |
126670697 |
1 |
FC13H15 |
AB13C15 |
-24.34 |
1.43 |
-9.54 |
0.02 |
0 |