List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
328647 |
126726240 |
1 |
O4N5C25H25 |
A4B5C25D25 |
-28.52 |
6.54 |
-8.67 |
-1.36 |
0 |
|
|
328648 |
126726258 |
2 |
NOC13H13 |
ABC13D13 |
25.2 |
3.79 |
-8.47 |
-0.17 |
0 |
|
|
328649 |
126726261 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-40.98 |
5.06 |
-8.52 |
-0.2 |
0 |
|
|
328650 |
126726269 |
1 |
O2N3C27H27 |
A2B3C27D27 |
5.31 |
6.28 |
-9.17 |
-0.56 |
0 |
|
|
328651 |
126726282 |
1 |
O2N3C27H27 |
A2B3C27D27 |
9.22 |
2.5 |
-9.22 |
-0.63 |
0 |
|
|
328652 |
126726283 |
1 |
N3O3C29H31 |
A3B3C29D31 |
-58.25 |
4.36 |
-9.26 |
-0.69 |
0 |
|
|
328653 |
126726286 |
1 |
ClO2N3H24C25 |
AB2C3D24E25 |
-9.65 |
3.93 |
-9.1 |
-0.61 |
0 |
|
|
328654 |
126726300 |
1 |
ClN3O3H22C24 |
AB3C3D22E24 |
-42.29 |
2.19 |
-9.18 |
-0.69 |
0 |
|
|
328655 |
126726327 |
1 |
N3O3F4H23C26 |
A3B3C4D23E26 |
-233.51 |
1.57 |
-9.53 |
-0.97 |
0 |
|
|
328656 |
126726332 |
1 |
F2N3O3H23C25 |
A2B3C3D23E25 |
-135.4 |
2.86 |
-9.34 |
-0.79 |
0 |
|
|
328657 |
126726337 |
1 |
N3O4C25H25 |
A3B4C25D25 |
-42.15 |
4.65 |
-9.38 |
-0.83 |
0 |
|
|
328658 |
126726338 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-41.39 |
3.25 |
-9.04 |
-0.41 |
0 |
|
|
328659 |
126726343 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-48.13 |
1.63 |
-9.04 |
-0.4 |
0 |
|
|
328660 |
126726344 |
1 |
O3N4H28C30 |
A3B4C28D30 |
-15.79 |
5.34 |
-8.55 |
-0.72 |
0 |
|
|
328661 |
126726347 |
1 |
O3N4H24C27 |
A3B4C24D27 |
6.91 |
3.45 |
-9.26 |
-0.86 |
0 |
|
|
328662 |
126726366 |
1 |
FO2N3C25H26 |
AB2C3D25E26 |
-52.9 |
5.93 |
-8.76 |
-0.63 |
0 |
|
|
328663 |
126726367 |
1 |
F2O2N3C25H25 |
A2B2C3D25E25 |
-99.71 |
6.05 |
-8.8 |
-0.42 |
0 |
|
|
328664 |
126726415 |
1 |
N3O4C26H27 |
A3B4C26D27 |
-85.75 |
4.36 |
-9.25 |
-0.6 |
0 |
|
|
328665 |
126726416 |
1 |
N3O4C29H31 |
A3B4C29D31 |
-78.1 |
2.98 |
-9.28 |
-0.72 |
0 |
|
|
328666 |
126726419 |
1 |
N3O4C27H27 |
A3B4C27D27 |
-57.6 |
3.71 |
-9.36 |
-0.73 |
0 |
|
|
328667 |
126726456 |
1 |
FO2N3H24C25 |
AB2C3D24E25 |
-44.04 |
3.31 |
-9.27 |
-0.69 |
0 |
|
|
328668 |
126726464 |
2 |
NOH12C14 |
ABC12D14 |
42.27 |
3.71 |
-8.69 |
-0.4 |
0 |
|
|
328669 |
126726466 |
3 |
NOC9H9 |
ABC9D9 |
-19.74 |
2.21 |
-9.37 |
-0.84 |
0 |
|
|
328670 |
126726471 |
1 |
N2O2H30C31 |
A2B2C30D31 |
24.98 |
5.54 |
-8.78 |
-0.45 |
0 |
|
|
328671 |
126726473 |
1 |
N3O3C29H31 |
A3B3C29D31 |
-57.61 |
1.86 |
-9.22 |
-0.61 |
0 |
|
|
328672 |
126726474 |
1 |
O2F3N3H20C24 |
A2B3C3D20E24 |
-128.74 |
3.56 |
-9.22 |
-0.64 |
0 |
|
|
328673 |
126726479 |
1 |
F2O2N3H21C24 |
A2B2C3D21E24 |
-89.73 |
5.01 |
-9.38 |
-0.86 |
0 |
|
|
328674 |
126726483 |
1 |
N2O3C28H30 |
A2B3C28D30 |
-31.71 |
2.75 |
-9.14 |
-0.56 |
0 |
|
|
328675 |
126726484 |
1 |
F2N2O5H28C29 |
A2B2C5D28E29 |
-236.4 |
6.45 |
-9.01 |
-0.44 |
0 |
|
|
328676 |
126726494 |
1 |
O2N3H21C22 |
A2B3C21D22 |
19.84 |
2.76 |
-8.76 |
-0.29 |
0 |
|
|
328677 |
126726511 |
1 |
ClON2H21C23 |
ABC2D21E23 |
34.96 |
6.44 |
-8.86 |
-0.44 |
0 |
|
|
328678 |
126726512 |
1 |
FON3H18C23 |
ABC3D18E23 |
39.07 |
6.4 |
-9.54 |
-1.13 |
0 |
|
|
328679 |
126726515 |
1 |
O2N4H24C27 |
A2B4C24D27 |
62.58 |
2.01 |
-9.4 |
-0.8 |
0 |
|
|
328680 |
126726517 |
1 |
N3O3C28H31 |
A3B3C28D31 |
-58.37 |
3.12 |
-9.19 |
-0.59 |
0 |
|
|
328681 |
126726520 |
1 |
FN3O3C26H26 |
AB3C3D26E26 |
-91.15 |
5.13 |
-9.39 |
-0.9 |
0 |
|
|
328682 |
126726522 |
1 |
N3O4C27H29 |
A3B4C27D29 |
-88.49 |
6.82 |
-8.76 |
-0.43 |
0 |
|
|
328683 |
126726536 |
2 |
FNH9C11 |
ABC9D11 |
-6.48 |
2.65 |
-8.73 |
-0.18 |
0 |
|
|
328684 |
126726542 |
2 |
FON2H11C13 |
ABC2D11E13 |
-57.69 |
3.1 |
-9.42 |
-0.82 |
0 |
|
|
328686 |
126726567 |
2 |
C8N9H14 |
A8B9C14 |
200.94 |
3.34 |
-6.92 |
-0.79 |
0 |
|
|
328687 |
126726568 |
1 |
S3N14C20H32 |
A3B14C20D32 |
111.9 |
6.53 |
-8.96 |
-0.39 |
0 |
|
|
328688 |
126726570 |
1 |
SN3O4C26H37 |
AB3C4D26E37 |
-126.17 |
2.09 |
-8.2 |
-0.04 |
0 |
|
|
328689 |
126726571 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-109.54 |
2.57 |
-8.41 |
-1.13 |
0 |
|
|
328690 |
126726572 |
1 |
SN5O5C23H23 |
AB5C5D23E23 |
-89.12 |
6.36 |
-8.93 |
-1.47 |
0 |
|
|
328691 |
126726575 |
1 |
O3C15H22 |
A3B15C22 |
-82.85 |
0.85 |
-9.67 |
0.75 |
0 |
|
|
328692 |
126726578 |
1 |
OC15H22 |
AB15C22 |
4.14 |
2.89 |
-9.72 |
0.58 |
0 |
|
|
328693 |
126726585 |
1 |
N2O2C19H24 |
A2B2C19D24 |
-11.2 |
2.8 |
-8.96 |
-0.23 |
0 |
|
|
328694 |
126726590 |
1 |
NO2C12H21 |
AB2C12D21 |
-99.34 |
5.53 |
-9.51 |
0.59 |
0 |
|
|
328695 |
126726592 |
1 |
N2O3C13H24 |
A2B3C13D24 |
-170.89 |
3.21 |
-9.66 |
0.71 |
0 |
|
|
328696 |
126726594 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-165.3 |
2.08 |
-9.45 |
0.37 |
0 |
|
|
328697 |
126726595 |
2 |
NO2C7H12 |
AB2C7D12 |
-213.56 |
5.79 |
-9.58 |
0.15 |
0 |
|
|
328698 |
126726600 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-172.98 |
3.75 |
-9.61 |
0.52 |
0 |
|
|
328699 |
126726601 |
1 |
N2O3C15H26 |
A2B3C15D26 |
-154.64 |
2.87 |
-8.89 |
0.4 |
0 |
|
|
328700 |
126726612 |
1 |
N3O4C14H19 |
A3B4C14D19 |
-133.36 |
6.5 |
-9.61 |
-1.45 |
0 |
|
|
328701 |
126726617 |
1 |
NO3C13H21 |
AB3C13D21 |
-156.48 |
3.45 |
-9.69 |
0.17 |
0 |
|
|
328702 |
126726620 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-160.99 |
3.82 |
-9.47 |
0.24 |
0 |
|
|
328703 |
126726640 |
1 |
N2O2C9H16 |
A2B2C9D16 |
-101.62 |
4.86 |
-9.41 |
0.75 |
0 |
|
|
328704 |
126726646 |
1 |
N3O4C12H23 |
A3B4C12D23 |
-210.81 |
1.77 |
-9.51 |
0.56 |
0 |
|
|
328705 |
126726655 |
1 |
SN2O4C9H18 |
AB2C4D9E18 |
-188.84 |
6.12 |
-10.11 |
-0.32 |
0 |
|
|
328706 |
126726662 |
1 |
N4C5H10 |
A4B5C10 |
32.58 |
2.66 |
-8.51 |
0.67 |
0 |
|
|
328707 |
126726665 |
1 |
ON3H21C24 |
AB3C21D24 |
114.54 |
1.48 |
-8.61 |
-0.6 |
0 |
|
|
328708 |
126726674 |
1 |
OC27H34 |
AB27C34 |
-14.4 |
0.97 |
-8.5 |
-0.26 |
0 |
|
|
328713 |
126726726 |
1 |
NSO4H35C50 |
ABC4D35E50 |
47.83 |
8.92 |
-8.17 |
-1.75 |
0 |
|
|
328714 |
126726730 |
1 |
NSO4H45C48 |
ABC4D45E48 |
-61.79 |
7.27 |
-8.12 |
-1.79 |
0 |
|
|
328715 |
126726732 |
1 |
NSO4H37C49 |
ABC4D37E49 |
29.62 |
6.69 |
-8.06 |
-1.87 |
0 |
|
|
328716 |
126726755 |
1 |
NSO5H43C51 |
ABC5D43E51 |
-38.93 |
10.68 |
-8.14 |
-1.38 |
0 |
|
|
328717 |
126726763 |
1 |
NS2O4H39C51 |
AB2C4D39E51 |
1.13 |
7.32 |
-8.0 |
-1.61 |
0 |
|
|
328718 |
126726769 |
1 |
NSO6H35C48 |
ABC6D35E48 |
-37.23 |
10.21 |
-8.04 |
-1.54 |
0 |
|
|
328719 |
126726784 |
1 |
NO4H29C40 |
AB4C29D40 |
4.63 |
10.46 |
-8.37 |
-1.49 |
0 |
|
|
328720 |
126726850 |
1 |
BrS2N3O3C19H24 |
AB2C3D3E19F24 |
-65.52 |
7.07 |
-8.63 |
-0.82 |
0 |
|
|
328722 |
126726886 |
2 |
ON2C14H14 |
AB2C14D14 |
26.85 |
2.38 |
-8.91 |
-1.18 |
0 |
|
|
328723 |
126726895 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-53.05 |
3.79 |
-9.73 |
-0.26 |
0 |
|
|
328724 |
126726929 |
1 |
SO3N6C18H20 |
AB3C6D18E20 |
-42.77 |
2.8 |
-8.88 |
-0.8 |
0 |
|
|
328725 |
126726930 |
1 |
ISO3N6C18H19 |
ABC3D6E18F19 |
-28.93 |
5.16 |
-8.76 |
-1.01 |
0 |
|
|
328726 |
126726933 |
1 |
SN12O13C61H92 |
AB12C13D61E92 |
-581.44 |
5.39 |
-8.84 |
-1.32 |
0 |
|
|
328727 |
126726936 |
1 |
ClC16H17 |
AB16C17 |
17.51 |
2.41 |
-9.26 |
-0.02 |
0 |