List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
91649 |
49977955 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-260.38 |
10.48 |
-8.9 |
-1.06 |
0 |
|
|
91650 |
49977961 |
1 |
ClN6O6C30H37 |
AB6C6D30E37 |
-235.87 |
6.13 |
-8.94 |
-1.04 |
0 |
|
|
91651 |
49977962 |
1 |
N5O5C30H39 |
A5B5C30D39 |
-193.68 |
5.88 |
-8.51 |
-0.82 |
0 |
|
|
91652 |
49977968 |
1 |
F2N6O6C37H42 |
A2B6C6D37E42 |
-292.66 |
4.44 |
-9.21 |
-0.99 |
0 |
|
|
91653 |
49977970 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-264.92 |
3.24 |
-8.78 |
-0.7 |
0 |
|
|
91654 |
49978015 |
1 |
N6O6C37H44 |
A6B6C37D44 |
-209.53 |
4.15 |
-8.34 |
-0.28 |
0 |
|
|
91655 |
49978016 |
6 |
NOC6H7 |
ABC6D7 |
-192.78 |
7.76 |
-8.66 |
-0.64 |
0 |
|
|
91656 |
49978019 |
6 |
NOC6H8 |
ABC6D8 |
-233.89 |
5.6 |
-9.08 |
-0.48 |
0 |
|
|
91657 |
49978024 |
1 |
N6O6C35H46 |
A6B6C35D46 |
-236.81 |
8.79 |
-8.95 |
-0.41 |
0 |
|
|
91658 |
49978038 |
1 |
F2N6O6C37H42 |
A2B6C6D37E42 |
-293.56 |
11.04 |
-8.83 |
-0.69 |
0 |
|
|
91659 |
49978040 |
1 |
FN6O6C36H41 |
AB6C6D36E41 |
-241.33 |
9.56 |
-8.49 |
-0.73 |
0 |
|
|
91660 |
49978041 |
1 |
N6O7C37H44 |
A6B7C37D44 |
-234.96 |
15.96 |
-8.72 |
-0.53 |
0 |
|
|
91661 |
49978066 |
1 |
Cl2N5O5C29H35 |
A2B5C5D29E35 |
-200.69 |
8.38 |
-8.96 |
-0.82 |
0 |
|
|
91662 |
49978070 |
1 |
N6O6C31H40 |
A6B6C31D40 |
-224.43 |
6.54 |
-9.06 |
-0.49 |
0 |
|
|
91663 |
49978071 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-239.42 |
4.88 |
-9.08 |
-0.31 |
0 |
|
|
91664 |
49978074 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-245.51 |
9.32 |
-9.09 |
-0.47 |
0 |
|
|
91665 |
49978075 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-243.78 |
6.65 |
-9.06 |
-0.51 |
0 |
|
|
91666 |
49978076 |
1 |
N6O6C31H40 |
A6B6C31D40 |
-227.33 |
11.18 |
-9.09 |
-0.46 |
0 |
|
|
91667 |
49978083 |
1 |
ClN6O6C30H37 |
AB6C6D30E37 |
-232.93 |
2.06 |
-9.24 |
-0.82 |
0 |
|
|
91668 |
49978088 |
1 |
ClN6O6C34H45 |
AB6C6D34E45 |
-253.06 |
11.11 |
-8.91 |
-0.76 |
0 |
|
|
91669 |
49978167 |
1 |
N5O6C30H39 |
A5B6C30D39 |
-224.67 |
6.98 |
-8.56 |
-0.37 |
0 |
|
|
91670 |
49978170 |
2 |
FN3O3C18H20 |
AB3C3D18E20 |
-282.01 |
4.43 |
-8.87 |
-0.82 |
0 |
|
|
91671 |
49978195 |
1 |
N6O7C37H50 |
A6B7C37D50 |
-276.94 |
5.61 |
-9.01 |
-0.47 |
0 |
|
|
91672 |
49978205 |
1 |
FN6O6C36H41 |
AB6C6D36E41 |
-244.81 |
3.96 |
-9.17 |
-0.82 |
0 |
|
|
91673 |
49978210 |
1 |
FN6O6C37H43 |
AB6C6D37E43 |
-254.1 |
8.76 |
-9.09 |
-0.72 |
0 |
|
|
91674 |
49978215 |
1 |
N6O7C37H44 |
A6B7C37D44 |
-233.0 |
13.97 |
-8.65 |
-0.64 |
0 |
|
|
91675 |
49978218 |
1 |
FN6O7C37H43 |
AB6C7D37E43 |
-284.42 |
9.72 |
-8.88 |
-0.65 |
0 |
|
|
91676 |
49978223 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-248.28 |
10.64 |
-9.05 |
-0.67 |
0 |
|
|
91677 |
49978226 |
1 |
SO5N7C28H39 |
AB5C7D28E39 |
-166.73 |
8.31 |
-8.88 |
-1.53 |
0 |
|
|
91678 |
49978235 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-230.82 |
8.21 |
-8.94 |
-0.46 |
0 |
|
|
91679 |
49978238 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-243.77 |
7.78 |
-9.06 |
-0.4 |
0 |
|
|
91680 |
49978239 |
1 |
SO5N7C27H37 |
AB5C7D27E37 |
-170.66 |
6.61 |
-9.21 |
-0.49 |
0 |
|
|
91681 |
49978241 |
1 |
F3N5O5C30H36 |
A3B5C5D30E36 |
-322.92 |
8.71 |
-8.95 |
-1.05 |
0 |
|
|
91682 |
49978271 |
1 |
FN6O6C37H49 |
AB6C6D37E49 |
-302.05 |
10.56 |
-8.74 |
-0.32 |
0 |
|
|
91683 |
49978278 |
1 |
F2N6O6C37H42 |
A2B6C6D37E42 |
-293.88 |
8.74 |
-9.0 |
-0.86 |
0 |
|
|
91684 |
49978281 |
1 |
FN5O5C30H38 |
AB5C5D30E38 |
-240.25 |
1.4 |
-8.92 |
-0.31 |
0 |
|
|
91685 |
49978283 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-255.1 |
9.68 |
-9.02 |
-0.67 |
0 |
|
|
91686 |
49978293 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-252.9 |
4.92 |
-9.11 |
-0.64 |
0 |
|
|
91687 |
49978294 |
2 |
N3O3C18H25 |
A3B3C18D25 |
-258.78 |
8.39 |
-8.92 |
-0.62 |
0 |
|
|
91688 |
49978305 |
1 |
FN6O6C39H47 |
AB6C6D39E47 |
-274.51 |
4.5 |
-8.85 |
-0.45 |
0 |
|
|
91689 |
49978307 |
1 |
FN6O6C34H45 |
AB6C6D34E45 |
-291.43 |
7.6 |
-8.88 |
-0.37 |
0 |
|
|
91690 |
49978309 |
1 |
FN6O6C32H41 |
AB6C6D32E41 |
-283.68 |
10.81 |
-9.09 |
-0.55 |
0 |
|
|
91691 |
49978314 |
1 |
ClN6O6C38H45 |
AB6C6D38E45 |
-230.08 |
7.22 |
-8.75 |
-0.52 |
0 |
|
|
91692 |
49978315 |
1 |
ClN6O6C38H45 |
AB6C6D38E45 |
-227.92 |
5.95 |
-8.72 |
-0.53 |
0 |
|
|
91693 |
49978326 |
1 |
ClN6O6C35H45 |
AB6C6D35E45 |
-237.45 |
5.55 |
-8.94 |
-0.64 |
0 |
|
|
91694 |
49978327 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-250.24 |
13.9 |
-8.95 |
-0.71 |
0 |
|
|
91695 |
49978331 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-263.18 |
7.72 |
-9.0 |
-0.91 |
0 |
|
|
91696 |
49978334 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-251.22 |
7.0 |
-8.67 |
-0.8 |
0 |
|
|
91697 |
49978337 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-254.53 |
3.23 |
-9.24 |
-0.89 |
0 |
|
|
91698 |
49978338 |
2 |
FN3O3C19H22 |
AB3C3D19E22 |
-304.78 |
13.25 |
-8.85 |
-1.1 |
0 |
|
|
91699 |
49978339 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-263.3 |
6.25 |
-8.88 |
-0.51 |
0 |
|
|
91700 |
49978341 |
1 |
BrN6O6C31H39 |
AB6C6D31E39 |
-232.56 |
6.37 |
-9.17 |
-0.74 |
0 |
|
|
91701 |
49978348 |
1 |
ClN6O6C33H43 |
AB6C6D33E43 |
-253.32 |
7.13 |
-8.72 |
-0.48 |
0 |
|
|
91703 |
49978370 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-252.16 |
5.75 |
-9.18 |
-0.61 |
0 |
|
|
91704 |
49978387 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-263.58 |
11.88 |
-8.99 |
-1.02 |
0 |
|
|
91705 |
49978388 |
1 |
ClN6O6C32H41 |
AB6C6D32E41 |
-242.81 |
14.26 |
-8.88 |
-1.04 |
0 |
|
|
91706 |
49978408 |
6 |
NOC6H8 |
ABC6D8 |
-247.09 |
12.45 |
-8.88 |
-0.57 |
0 |
|
|
91707 |
49978410 |
2 |
N3O3C19H26 |
A3B3C19D26 |
-257.79 |
10.81 |
-8.87 |
-0.56 |
0 |
|
|
91708 |
49978411 |
1 |
N6O6C35H48 |
A6B6C35D48 |
-249.69 |
6.8 |
-8.68 |
-0.89 |
0 |
|
|
91709 |
49978412 |
2 |
N3O3C16H21 |
A3B3C16D21 |
-229.59 |
11.3 |
-9.03 |
-0.47 |
0 |
|
|
91710 |
49978424 |
1 |
N6O6C37H44 |
A6B6C37D44 |
-206.72 |
12.32 |
-8.9 |
-0.93 |
0 |
|
|
91711 |
49978426 |
1 |
ClN6O6C37H43 |
AB6C6D37E43 |
-213.85 |
8.89 |
-8.97 |
-1.22 |
0 |
|
|
91712 |
49978429 |
1 |
ClN6O6C33H43 |
AB6C6D33E43 |
-240.59 |
6.48 |
-9.08 |
-0.88 |
0 |
|
|
91713 |
49978431 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-256.0 |
8.42 |
-9.12 |
-0.77 |
0 |
|
|
91714 |
49978436 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-254.08 |
5.3 |
-9.2 |
-0.74 |
0 |
|
|
91715 |
49978441 |
1 |
ClN5O5C31H40 |
AB5C5D31E40 |
-209.57 |
4.68 |
-8.84 |
-0.22 |
0 |
|
|
91716 |
49978442 |
1 |
ClN5O5C31H40 |
AB5C5D31E40 |
-208.12 |
10.11 |
-8.69 |
-0.15 |
0 |
|
|
91717 |
49978444 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-254.4 |
5.25 |
-8.98 |
-0.41 |
0 |
|
|
91718 |
49978447 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-254.67 |
6.7 |
-9.23 |
-0.61 |
0 |
|
|
91719 |
49978448 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-253.4 |
9.43 |
-8.93 |
-0.64 |
0 |
|
|
91720 |
49978450 |
1 |
N6O6C37H44 |
A6B6C37D44 |
-198.62 |
8.94 |
-8.87 |
-0.47 |
0 |
|
|
91721 |
49978455 |
1 |
FN6O6C37H43 |
AB6C6D37E43 |
-254.12 |
11.18 |
-8.9 |
-0.95 |
0 |
|
|
91722 |
49978458 |
1 |
FN6O6C37H43 |
AB6C6D37E43 |
-254.61 |
10.38 |
-8.85 |
-1.01 |
0 |
|
|
91723 |
49978459 |
1 |
F2N6O6C37H42 |
A2B6C6D37E42 |
-302.63 |
12.93 |
-8.77 |
-1.35 |
0 |
|
|
91724 |
49978468 |
1 |
ClN6O6C36H47 |
AB6C6D36E47 |
-255.43 |
11.36 |
-8.76 |
-1.02 |
0 |
|
|
91725 |
49978469 |
1 |
ClN6O6C37H49 |
AB6C6D37E49 |
-268.47 |
5.48 |
-8.9 |
-0.88 |
0 |
|
|
91726 |
49978470 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-265.57 |
6.45 |
-8.97 |
-0.95 |
0 |
|
|
91727 |
49978471 |
1 |
ClN6O6C32H41 |
AB6C6D32E41 |
-243.76 |
6.88 |
-8.93 |
-0.91 |
0 |
|
|
91728 |
49978477 |
2 |
N3O3C19H23 |
A3B3C19D23 |
-217.22 |
5.34 |
-8.42 |
-0.4 |
0 |
|
|
91730 |
49978482 |
1 |
FN6O6C38H45 |
AB6C6D38E45 |
-257.25 |
4.06 |
-8.94 |
-0.61 |
0 |
|
|
91731 |
49978484 |
1 |
N6O6C33H44 |
A6B6C33D44 |
-232.15 |
9.52 |
-8.88 |
-0.44 |
0 |
|
|
91732 |
49978485 |
2 |
N3O3C17H23 |
A3B3C17D23 |
-246.65 |
10.75 |
-8.86 |
-0.52 |
0 |
|
|
91733 |
49978490 |
6 |
NOC6H8 |
ABC6D8 |
-244.21 |
5.42 |
-9.04 |
-0.52 |
0 |
|
|
91734 |
49978492 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-257.03 |
11.88 |
-8.98 |
-0.8 |
0 |
|
|
91735 |
49978493 |
1 |
ClN6O6C35H45 |
AB6C6D35E45 |
-245.9 |
12.26 |
-8.83 |
-0.82 |
0 |
|
|
91736 |
49978499 |
1 |
ClN6O6C35H47 |
AB6C6D35E47 |
-255.57 |
5.07 |
-9.35 |
-0.64 |
0 |
|
|
91737 |
49978507 |
1 |
FN6O6C37H43 |
AB6C6D37E43 |
-250.3 |
9.43 |
-8.37 |
-0.65 |
0 |
|
|
91738 |
49978519 |
1 |
N5O5C33H45 |
A5B5C33D45 |
-181.07 |
7.56 |
-8.86 |
-0.5 |
0 |
|
|
91739 |
49978523 |
6 |
NOC6H8 |
ABC6D8 |
-248.79 |
8.53 |
-8.9 |
-0.41 |
0 |
|
|
91740 |
49978541 |
1 |
N6O7C39H48 |
A6B7C39D48 |
-248.14 |
9.25 |
-8.54 |
-0.23 |
0 |
|
|
91741 |
49978553 |
1 |
N6O6C37H44 |
A6B6C37D44 |
-204.06 |
9.47 |
-8.94 |
-0.94 |
0 |
|
|
91742 |
49978561 |
2 |
N3O3C16H21 |
A3B3C16D21 |
-239.59 |
10.1 |
-9.13 |
-0.41 |
0 |
|
|
91743 |
49978575 |
1 |
N6O7C39H48 |
A6B7C39D48 |
-256.34 |
7.11 |
-8.15 |
-0.47 |
0 |
|
|
91744 |
49978576 |
1 |
ClN6O6C38H45 |
AB6C6D38E45 |
-220.1 |
6.11 |
-8.62 |
-0.67 |
0 |
|
|
91745 |
49978579 |
1 |
ClN6O6C38H45 |
AB6C6D38E45 |
-222.26 |
6.84 |
-8.41 |
-0.73 |
0 |
|
|
91746 |
49978599 |
1 |
N6O7C36H48 |
A6B7C36D48 |
-271.11 |
8.99 |
-9.04 |
-0.39 |
0 |
|
|
91747 |
49978602 |
3 |
N2O2C13H18 |
A2B2C13D18 |
-264.56 |
7.37 |
-8.99 |
-0.32 |
0 |
|
|
91748 |
49978605 |
1 |
O5N6C38H46 |
A5B6C38D46 |
-181.48 |
7.3 |
-8.75 |
-0.91 |
0 |
|
|
91749 |
49978606 |
1 |
FO5N6C37H43 |
AB5C6D37E43 |
-223.97 |
10.82 |
-9.04 |
-0.87 |
0 |
|
|
91750 |
49978611 |
1 |
O5N6C34H46 |
A5B6C34D46 |
-209.96 |
6.26 |
-8.95 |
-0.25 |
0 |