List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
281300 |
103913668 |
1 |
ClF2N2H9C14 |
AB2C2D9E14 |
-18.69 |
4.37 |
-8.83 |
-1.26 |
0 |
|
|
281301 |
103913669 |
1 |
F2N2H12C15 |
A2B2C12D15 |
-21.63 |
4.52 |
-8.73 |
-1.14 |
0 |
|
|
281302 |
103913670 |
1 |
N2F4H10C15 |
A2B4C10D15 |
-129.9 |
4.52 |
-9.11 |
-1.32 |
0 |
|
|
281303 |
103913671 |
1 |
FON2H15C16 |
ABC2D15E16 |
-14.2 |
5.51 |
-8.75 |
-0.86 |
0 |
|
|
281304 |
103913673 |
1 |
FN2H17C18 |
AB2C17D18 |
17.32 |
4.01 |
-8.42 |
-1.0 |
0 |
|
|
281305 |
103913674 |
1 |
F2N2H12C15 |
A2B2C12D15 |
-19.57 |
4.32 |
-8.56 |
-1.04 |
0 |
|
|
281306 |
103913676 |
1 |
ClFON2H12C15 |
ABCD2E12F15 |
-11.34 |
4.03 |
-8.37 |
-1.08 |
0 |
|
|
281307 |
103913681 |
1 |
FN2H15C16 |
AB2C15D16 |
24.55 |
4.21 |
-8.82 |
-0.94 |
0 |
|
|
281308 |
103913682 |
1 |
F2N2H12C15 |
A2B2C12D15 |
-20.24 |
3.44 |
-8.64 |
-1.1 |
0 |
|
|
281309 |
103913684 |
1 |
N2F3H9C14 |
A2B3C9D14 |
-63.9 |
4.9 |
-9.08 |
-1.36 |
0 |
|
|
281310 |
103913685 |
1 |
BrFN2H10C14 |
ABC2D10E14 |
33.41 |
3.49 |
-8.77 |
-1.09 |
0 |
|
|
281311 |
103913686 |
1 |
FN2C17H17 |
AB2C17D17 |
18.91 |
3.77 |
-8.5 |
-0.95 |
0 |
|
|
281312 |
103913688 |
1 |
FCl2N2H9C14 |
AB2C2D9E14 |
20.05 |
5.33 |
-8.79 |
-1.27 |
0 |
|
|
281313 |
103913689 |
1 |
BrFN2H12C15 |
ABC2D12E15 |
24.31 |
4.05 |
-8.59 |
-1.03 |
0 |
|
|
281314 |
103913692 |
1 |
BrF2N2H9C14 |
AB2C2D9E14 |
-6.73 |
3.85 |
-8.83 |
-1.26 |
0 |
|
|
281315 |
103913693 |
1 |
FN2H15C16 |
AB2C15D16 |
20.49 |
4.42 |
-8.88 |
-0.94 |
0 |
|
|
281316 |
103913694 |
2 |
NF2H4C7 |
AB2C4D7 |
-97.85 |
3.52 |
-9.1 |
-1.25 |
0 |
|
|
281317 |
103913695 |
1 |
FN2C18H19 |
AB2C18D19 |
14.83 |
3.78 |
-8.43 |
-1.04 |
0 |
|
|
281318 |
103913696 |
1 |
FON3H12C15 |
ABC3D12E15 |
-8.79 |
2.48 |
-8.88 |
-1.25 |
0 |
|
|
281319 |
103913698 |
1 |
FN2H15C16 |
AB2C15D16 |
21.8 |
3.86 |
-8.42 |
-1.04 |
0 |
|
|
281320 |
103913699 |
1 |
FN2H15C16 |
AB2C15D16 |
17.29 |
4.08 |
-8.31 |
-1.02 |
0 |
|
|
281321 |
103913701 |
1 |
FN2H13C15 |
AB2C13D15 |
26.09 |
4.27 |
-8.43 |
-0.96 |
0 |
|
|
281322 |
103913702 |
1 |
FN2C17H17 |
AB2C17D17 |
16.54 |
4.08 |
-8.41 |
-1.01 |
0 |
|
|
281323 |
103913703 |
1 |
FN2H15C16 |
AB2C15D16 |
13.64 |
3.95 |
-8.51 |
-1.02 |
0 |
|
|
281324 |
103913705 |
1 |
NSO2C16H19 |
ABC2D16E19 |
-46.89 |
8.63 |
-8.06 |
-0.52 |
0 |
|
|
281325 |
103913706 |
1 |
FN2H11C16 |
AB2C11D16 |
89.27 |
3.42 |
-8.7 |
-1.11 |
0 |
|
|
281326 |
103913707 |
1 |
ON2F3H11C15 |
AB2C3D11E15 |
-110.71 |
1.69 |
-8.91 |
-1.18 |
0 |
|
|
281327 |
103913709 |
1 |
FON2H15C16 |
ABC2D15E16 |
-12.22 |
4.69 |
-8.15 |
-0.96 |
0 |
|
|
281328 |
103913711 |
2 |
NF2C6H6 |
AB2C6D6 |
-159.07 |
6.7 |
-10.05 |
-0.89 |
0 |
|
|
281329 |
103913712 |
1 |
N2C17H24 |
A2B17C24 |
20.71 |
5.6 |
-9.24 |
-0.56 |
0 |
|
|
281330 |
103913713 |
1 |
ON2C15H22 |
AB2C15D22 |
-21.68 |
4.32 |
-9.41 |
-0.65 |
0 |
|
|
281331 |
103913716 |
1 |
ON2C15H20 |
AB2C15D20 |
19.92 |
5.62 |
-9.25 |
-0.52 |
0 |
|
|
281332 |
103913717 |
1 |
ON3C13H13 |
AB3C13D13 |
72.65 |
5.06 |
-9.78 |
-0.75 |
0 |
|
|
281333 |
103913718 |
1 |
ON3C14H15 |
AB3C14D15 |
36.26 |
6.88 |
-9.59 |
-0.62 |
0 |
|
|
281334 |
103913722 |
1 |
ON3C15H17 |
AB3C15D17 |
30.7 |
4.8 |
-9.19 |
-0.63 |
0 |
|
|
281335 |
103913724 |
2 |
NC7H9 |
AB7C9 |
45.22 |
5.95 |
-9.21 |
-0.42 |
0 |
|
|
281336 |
103913725 |
1 |
ON3C14H19 |
AB3C14D19 |
-1.17 |
2.23 |
-9.37 |
-0.79 |
0 |
|
|
281337 |
103913726 |
1 |
SO2N3C13H19 |
AB2C3D13E19 |
-40.26 |
6.29 |
-9.42 |
-0.54 |
0 |
|
|
281338 |
103913727 |
2 |
NOC8H12 |
ABC8D12 |
-42.69 |
5.52 |
-8.96 |
0.01 |
0 |
|
|
281339 |
103913728 |
1 |
ON2F4C13H14 |
AB2C4D13E14 |
-193.41 |
3.07 |
-9.35 |
-0.28 |
0 |
|
|
281340 |
103913729 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-48.08 |
3.97 |
-9.09 |
-0.03 |
0 |
|
|
281341 |
103913731 |
2 |
NOC8H12 |
ABC8D12 |
-55.23 |
4.03 |
-9.16 |
-0.11 |
0 |
|
|
281342 |
103913732 |
1 |
OSN3C16H19 |
ABC3D16E19 |
35.69 |
4.95 |
-9.0 |
-0.42 |
0 |
|
|
281343 |
103913733 |
2 |
ON2C7H8 |
AB2C7D8 |
37.11 |
3.42 |
-9.15 |
-0.38 |
0 |
|
|
281344 |
103913737 |
1 |
O2N3C15H17 |
A2B3C15D17 |
2.62 |
5.52 |
-9.12 |
-0.05 |
0 |
|
|
281345 |
103913738 |
1 |
ON2C15H18 |
AB2C15D18 |
60.16 |
4.51 |
-9.07 |
-0.06 |
0 |
|
|
281346 |
103913739 |
1 |
ON4C16H20 |
AB4C16D20 |
51.26 |
4.13 |
-9.14 |
-0.17 |
0 |
|
|
281347 |
103913740 |
1 |
O2N3C16H19 |
A2B3C16D19 |
1.31 |
5.93 |
-9.13 |
-0.06 |
0 |
|
|
281348 |
103913742 |
1 |
OSN3C16H23 |
ABC3D16E23 |
12.63 |
3.15 |
-8.53 |
-0.1 |
0 |
|
|
281349 |
103913743 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-35.76 |
7.65 |
-8.94 |
0.13 |
0 |
|
|
281350 |
103913744 |
1 |
SN3O3C14H21 |
AB3C3D14E21 |
-73.49 |
7.16 |
-9.04 |
0.01 |
0 |
|
|
281351 |
103913745 |
2 |
NOC8H12 |
ABC8D12 |
-52.7 |
4.21 |
-9.05 |
0.02 |
0 |
|
|
281352 |
103913746 |
1 |
NOC14H23 |
ABC14D23 |
-49.67 |
0.77 |
-9.11 |
0.43 |
0 |
|
|
281353 |
103913747 |
1 |
FN2H15C16 |
AB2C15D16 |
25.53 |
1.21 |
-9.35 |
-0.9 |
0 |
|
|
281354 |
103913749 |
1 |
NSC13H21 |
ABC13D21 |
4.29 |
2.58 |
-8.53 |
0.35 |
0 |
|
|
281355 |
103913750 |
1 |
FN2H15C16 |
AB2C15D16 |
28.27 |
4.64 |
-9.32 |
-0.83 |
0 |
|
|
281356 |
103913751 |
1 |
ON2C13H18 |
AB2C13D18 |
-32.57 |
4.58 |
-9.24 |
0.3 |
0 |
|
|
281357 |
103913752 |
1 |
NSC11H17 |
ABC11D17 |
14.14 |
1.26 |
-8.59 |
0.47 |
0 |
|
|
281358 |
103913754 |
1 |
ON3C12H15 |
AB3C12D15 |
24.97 |
3.6 |
-9.48 |
-0.25 |
0 |
|
|
281359 |
103913757 |
1 |
NOC12H19 |
ABC12D19 |
-43.3 |
3.81 |
-9.25 |
0.33 |
0 |
|
|
281360 |
103913758 |
1 |
N2C15H18 |
A2B15C18 |
43.38 |
1.29 |
-9.09 |
-0.05 |
0 |
|
|
281361 |
103913759 |
1 |
NC12H17 |
AB12C17 |
26.93 |
1.58 |
-8.96 |
0.4 |
0 |
|
|
281362 |
103913762 |
1 |
NSC12H19 |
ABC12D19 |
9.21 |
1.32 |
-8.58 |
0.32 |
0 |
|
|
281363 |
103913763 |
1 |
NOC14H23 |
ABC14D23 |
-50.58 |
1.44 |
-9.05 |
0.28 |
0 |
|
|
281364 |
103913764 |
1 |
FN2H15C16 |
AB2C15D16 |
24.62 |
1.1 |
-9.33 |
-0.83 |
0 |
|
|
281365 |
103913765 |
1 |
ON3C12H15 |
AB3C12D15 |
38.59 |
2.4 |
-9.19 |
-0.2 |
0 |
|
|
281366 |
103913767 |
1 |
FN2H15C16 |
AB2C15D16 |
29.29 |
4.34 |
-9.42 |
-0.9 |
0 |
|
|
281367 |
103913768 |
1 |
ON2C13H18 |
AB2C13D18 |
-33.84 |
5.0 |
-9.37 |
0.04 |
0 |
|
|
281368 |
103913771 |
1 |
SN2O2C10H16 |
AB2C2D10E16 |
-63.49 |
3.63 |
-9.34 |
0.14 |
0 |
|
|
281369 |
103913772 |
1 |
ON3C12H15 |
AB3C12D15 |
23.73 |
3.82 |
-9.39 |
-0.17 |
0 |
|
|
281370 |
103913773 |
1 |
N4C15H20 |
A4B15C20 |
55.43 |
6.27 |
-9.45 |
0.13 |
0 |
|
|
281371 |
103913774 |
1 |
NSO2C13H21 |
ABC2D13E21 |
-79.58 |
4.84 |
-9.22 |
0.22 |
0 |
|
|
281372 |
103913775 |
1 |
NOC12H19 |
ABC12D19 |
-44.25 |
3.39 |
-9.23 |
0.15 |
0 |
|
|
281373 |
103913776 |
1 |
N2C15H18 |
A2B15C18 |
42.4 |
0.86 |
-9.09 |
-0.02 |
0 |
|
|
281374 |
103913777 |
1 |
NC12H17 |
AB12C17 |
25.93 |
1.1 |
-8.97 |
0.28 |
0 |
|
|
281375 |
103913779 |
1 |
NC13H19 |
AB13C19 |
13.38 |
1.92 |
-8.79 |
0.29 |
0 |
|
|
281376 |
103913781 |
1 |
NC14H19 |
AB14C19 |
20.29 |
1.65 |
-8.9 |
0.36 |
0 |
|
|
281377 |
103913782 |
1 |
NSC12H19 |
ABC12D19 |
8.15 |
1.04 |
-8.53 |
0.24 |
0 |
|
|
281378 |
103913784 |
1 |
NSO3C14H21 |
ABC3D14E21 |
-117.99 |
5.83 |
-8.7 |
0.32 |
0 |
|
|
281379 |
103913785 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-119.14 |
4.99 |
-8.6 |
0.32 |
0 |
|
|
281380 |
103913787 |
1 |
ON3C15H21 |
AB3C15D21 |
3.71 |
4.87 |
-8.84 |
0.17 |
0 |
|
|
281381 |
103913789 |
1 |
NSO2C13H27 |
ABC2D13E27 |
-125.72 |
4.29 |
-9.1 |
0.87 |
0 |
|
|
281382 |
103913790 |
1 |
N2S2O4C9H20 |
A2B2C4D9E20 |
-193.72 |
3.1 |
-9.04 |
0.81 |
0 |
|
|
281383 |
103913791 |
2 |
NSO2C4H10 |
ABC2D4E10 |
-187.93 |
2.75 |
-9.34 |
0.67 |
0 |
|
|
281384 |
103913792 |
2 |
NSO2C5H11 |
ABC2D5E11 |
-195.29 |
5.17 |
-9.52 |
0.81 |
0 |
|
|
281385 |
103913793 |
1 |
SO2N4C10H20 |
AB2C4D10E20 |
-65.3 |
5.24 |
-9.05 |
0.41 |
0 |
|
|
281386 |
103913796 |
1 |
N4C13H26 |
A4B13C26 |
8.03 |
5.08 |
-8.62 |
1.03 |
0 |
|
|
281387 |
103913797 |
1 |
NSO2C16H25 |
ABC2D16E25 |
-91.39 |
4.42 |
-9.08 |
0.59 |
0 |
|
|
281388 |
103913798 |
1 |
NSO2C15H25 |
ABC2D15E25 |
-88.27 |
4.64 |
-8.9 |
0.4 |
0 |
|
|
281389 |
103913799 |
1 |
SN2O2C14H28 |
AB2C2D14E28 |
-124.02 |
5.96 |
-8.34 |
0.95 |
0 |
|
|
281390 |
103913800 |
2 |
NOSC5H9 |
ABCD5E9 |
-76.67 |
5.75 |
-8.95 |
-0.46 |
0 |
|
|
281391 |
103913802 |
1 |
SN4C12H18 |
AB4C12D18 |
46.57 |
4.17 |
-9.03 |
-0.4 |
0 |
|
|
281392 |
103913803 |
1 |
NO3C15H25 |
AB3C15D25 |
-123.25 |
3.46 |
-8.42 |
-0.08 |
0 |
|
|
281393 |
103913807 |
1 |
NO2C17H27 |
AB2C17D27 |
-96.02 |
5.11 |
-8.05 |
0.2 |
0 |
|
|
281394 |
103913808 |
2 |
NO2C8H13 |
AB2C8D13 |
-185.25 |
5.42 |
-8.2 |
0.07 |
0 |
|
|
281395 |
103913809 |
1 |
NO3C15H25 |
AB3C15D25 |
-139.37 |
3.5 |
-8.27 |
0.0 |
0 |
|
|
281396 |
103913810 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-47.93 |
5.04 |
-8.18 |
-0.49 |
0 |
|
|
281397 |
103913811 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-46.22 |
4.45 |
-8.23 |
-0.4 |
0 |
|
|
281398 |
103913812 |
1 |
NO3C15H23 |
AB3C15D23 |
-98.88 |
4.73 |
-8.07 |
0.21 |
0 |
|
|
281399 |
103913813 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-40.71 |
1.9 |
-8.36 |
-0.32 |
0 |