List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
130407 |
51075842 |
1 |
NOCl2C11H17 |
ABC2D11E17 |
-47.64 |
5.32 |
-9.52 |
0.37 |
0 |
|
|
130408 |
51075845 |
1 |
OSN3C11H17 |
ABC3D11E17 |
4.19 |
5.5 |
-9.79 |
-1.16 |
0 |
|
|
130409 |
51075847 |
1 |
SN3O3C15H17 |
AB3C3D15E17 |
-71.69 |
4.01 |
-8.94 |
-0.36 |
0 |
|
|
130410 |
51075853 |
1 |
SO2N3C13H17 |
AB2C3D13E17 |
-41.88 |
5.94 |
-9.04 |
-0.38 |
0 |
|
|
130411 |
51075854 |
1 |
SN3O3C16H17 |
AB3C3D16E17 |
-39.77 |
9.6 |
-9.18 |
-1.23 |
0 |
|
|
130412 |
51075857 |
1 |
N2O4C17H18 |
A2B4C17D18 |
-111.86 |
2.97 |
-8.82 |
-0.18 |
0 |
|
|
130413 |
51075861 |
1 |
NOC14H15 |
ABC14D15 |
27.43 |
3.34 |
-9.24 |
-0.24 |
0 |
|
|
130414 |
51075868 |
1 |
OSN2C12H20 |
ABC2D12E20 |
-48.71 |
4.45 |
-9.25 |
-0.56 |
0 |
|
|
130415 |
51075877 |
1 |
SN3O4C15H15 |
AB3C4D15E15 |
-21.71 |
3.6 |
-9.14 |
-1.27 |
0 |
|
|
130416 |
51075878 |
1 |
NF3O3C17H20 |
AB3C3D17E20 |
-278.23 |
2.81 |
-9.61 |
-0.99 |
0 |
|
|
130417 |
51075879 |
1 |
SN2O3C17H22 |
AB2C3D17E22 |
-102.49 |
3.85 |
-8.56 |
-0.05 |
0 |
|
|
130418 |
51075887 |
1 |
ClON4C15H19 |
ABC4D15E19 |
35.51 |
1.69 |
-8.57 |
-0.44 |
0 |
|
|
130419 |
51075889 |
1 |
O2N3C16H31 |
A2B3C16D31 |
-124.47 |
4.11 |
-8.65 |
1.21 |
0 |
|
|
130420 |
51075890 |
1 |
ON3C12H21 |
AB3C12D21 |
0.34 |
1.45 |
-9.04 |
-0.3 |
0 |
|
|
130421 |
51075894 |
1 |
ClON3C13H16 |
ABC3D13E16 |
28.87 |
1.69 |
-9.26 |
-0.3 |
0 |
|
|
130422 |
51075897 |
1 |
O2N3C17H19 |
A2B3C17D19 |
32.86 |
1.24 |
-9.35 |
-0.43 |
0 |
|
|
130423 |
51075899 |
1 |
ON3C13H21 |
AB3C13D21 |
-8.39 |
3.51 |
-9.07 |
-0.08 |
0 |
|
|
130424 |
51075909 |
1 |
OSN3C13H19 |
ABC3D13E19 |
27.53 |
1.73 |
-8.81 |
-0.22 |
0 |
|
|
130425 |
51085175 |
1 |
O2N3C17H17 |
A2B3C17D17 |
-26.86 |
8.19 |
-8.24 |
-0.45 |
0 |
|
|
130426 |
51085176 |
1 |
O2N4H16C17 |
A2B4C16D17 |
1.12 |
2.96 |
-8.66 |
-0.79 |
0 |
|
|
130427 |
51085303 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-103.17 |
2.91 |
-8.32 |
-0.05 |
0 |
|
|
130428 |
51085304 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-60.89 |
7.89 |
-8.58 |
0.13 |
0 |
|
|
130429 |
51087546 |
1 |
S2N3O3C14H17 |
A2B3C3D14E17 |
-70.97 |
8.81 |
-9.5 |
-0.72 |
0 |
|
|
130430 |
51088028 |
1 |
NS2O3C17H19 |
AB2C3D17E19 |
-88.46 |
5.23 |
-9.1 |
-0.7 |
0 |
|
|
130431 |
51088029 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-61.89 |
6.76 |
-8.46 |
0.06 |
0 |
|
|
130432 |
51088030 |
1 |
N2O2C21H28 |
A2B2C21D28 |
-78.71 |
3.73 |
-9.04 |
0.12 |
0 |
|
|
130433 |
51090850 |
1 |
O3N4H14C17 |
A3B4C14D17 |
-6.46 |
5.8 |
-9.1 |
-1.18 |
0 |
|
|
130434 |
51090851 |
1 |
OSN6C15H18 |
ABC6D15E18 |
53.54 |
3.7 |
-8.94 |
-1.01 |
0 |
|
|
130435 |
51090855 |
2 |
ON2C8H10 |
AB2C8D10 |
-23.21 |
6.85 |
-9.48 |
-1.02 |
0 |
|
|
130436 |
51090856 |
1 |
ON7C18H19 |
AB7C18D19 |
96.92 |
5.57 |
-9.16 |
-1.66 |
0 |
|
|
130437 |
51090858 |
1 |
O3N5C16H19 |
A3B5C16D19 |
-85.27 |
1.95 |
-8.84 |
-0.89 |
0 |
|
|
130438 |
51090863 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-71.28 |
1.57 |
-8.83 |
-0.34 |
0 |
|
|
130439 |
51090864 |
1 |
OSN4C18H22 |
ABC4D18E22 |
16.0 |
5.76 |
-8.93 |
-0.45 |
0 |
|
|
130440 |
51090866 |
1 |
ON5C18H19 |
AB5C18D19 |
39.79 |
8.06 |
-8.66 |
-0.64 |
0 |
|
|
130441 |
51090867 |
1 |
ON7C15H17 |
AB7C15D17 |
69.5 |
6.48 |
-8.94 |
-0.61 |
0 |
|
|
130442 |
51090870 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-46.8 |
6.85 |
-8.58 |
-0.25 |
0 |
|
|
130443 |
51090873 |
1 |
OSN4C16H22 |
ABC4D16E22 |
-1.9 |
7.21 |
-8.64 |
-0.38 |
0 |
|
|
130444 |
51090874 |
2 |
ON2C9H12 |
AB2C9D12 |
-25.6 |
5.76 |
-8.44 |
-0.51 |
0 |
|
|
130445 |
51090875 |
1 |
FO2N5C17H18 |
AB2C5D17E18 |
-36.4 |
7.75 |
-9.61 |
-1.02 |
0 |
|
|
130446 |
51090876 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-23.22 |
4.6 |
-8.27 |
-0.27 |
0 |
|
|
130447 |
51090877 |
3 |
FNOC5H6 |
ABCD5E6 |
-284.57 |
2.11 |
-9.98 |
-0.79 |
0 |
|
|
130448 |
51090879 |
1 |
ON4C20H20 |
AB4C20D20 |
78.36 |
5.31 |
-9.06 |
-0.81 |
0 |
|
|
130449 |
51090880 |
1 |
ClO2N3C18H20 |
AB2C3D18E20 |
-12.95 |
3.16 |
-9.78 |
-0.97 |
0 |
|
|
130450 |
51090881 |
1 |
O3N4H16C18 |
A3B4C16D18 |
46.83 |
4.62 |
-9.65 |
-1.44 |
0 |
|
|
130451 |
51090882 |
1 |
O3N4H16C18 |
A3B4C16D18 |
47.18 |
6.17 |
-9.59 |
-1.67 |
0 |
|
|
130452 |
51090883 |
1 |
OSN3C16H25 |
ABC3D16E25 |
-40.1 |
4.18 |
-8.92 |
-0.22 |
0 |
|
|
130453 |
51090884 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-62.35 |
5.69 |
-9.06 |
-0.9 |
0 |
|
|
130454 |
51090886 |
1 |
FN3O3C17H22 |
AB3C3D17E22 |
-132.46 |
5.48 |
-9.81 |
-1.39 |
0 |
|
|
130455 |
51090888 |
1 |
N3O4C18H25 |
A3B4C18D25 |
-144.04 |
3.13 |
-9.14 |
-0.2 |
0 |
|
|
130456 |
51090889 |
1 |
O2N3C19H25 |
A2B3C19D25 |
-39.74 |
7.18 |
-8.86 |
-0.63 |
0 |
|
|
130457 |
51090890 |
1 |
ON3C18H23 |
AB3C18D23 |
-1.66 |
5.53 |
-8.83 |
-0.84 |
0 |
|
|
130458 |
51090894 |
1 |
OF3N4C16H27 |
AB3C4D16E27 |
-197.24 |
3.48 |
-8.45 |
-0.46 |
0 |
|
|
130459 |
51090896 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-180.48 |
4.39 |
-9.65 |
0.32 |
0 |
|
|
130460 |
51090898 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-50.62 |
3.74 |
-8.23 |
-0.77 |
0 |
|
|
130461 |
51090900 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-50.34 |
3.27 |
-8.23 |
-0.71 |
0 |
|
|
130462 |
51090901 |
1 |
SN3O4C13H25 |
AB3C4D13E25 |
-198.42 |
2.96 |
-9.63 |
0.49 |
0 |
|
|
130463 |
51090905 |
1 |
OSN4C18H20 |
ABC4D18E20 |
77.15 |
10.59 |
-8.88 |
-0.51 |
0 |
|
|
130464 |
51090906 |
1 |
S2N3O3H13C15 |
A2B3C3D13E15 |
-26.69 |
4.94 |
-8.79 |
-1.52 |
0 |
|
|
130465 |
51090907 |
1 |
N3O3H17C18 |
A3B3C17D18 |
-40.84 |
2.67 |
-8.73 |
-0.64 |
0 |
|
|
130466 |
51090913 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-68.06 |
3.61 |
-9.19 |
-0.86 |
0 |
|
|
130467 |
51090914 |
1 |
NO3C16H21 |
AB3C16D21 |
-66.85 |
2.91 |
-9.4 |
-0.37 |
0 |
|
|
130468 |
51090916 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-135.44 |
0.85 |
-9.24 |
-0.05 |
0 |
|
|
130469 |
51090918 |
1 |
N3O3C19H27 |
A3B3C19D27 |
-108.93 |
2.28 |
-8.85 |
0.03 |
0 |
|
|
130470 |
51090919 |
1 |
FNO3C16H20 |
ABC3D16E20 |
-159.84 |
3.27 |
-9.17 |
-0.47 |
0 |
|
|
130471 |
51090920 |
1 |
OF3N4C15H23 |
AB3C4D15E23 |
-191.85 |
6.12 |
-9.54 |
0.43 |
0 |
|
|
130472 |
51090922 |
1 |
N2O2F3C17H23 |
A2B2C3D17E23 |
-236.97 |
6.19 |
-9.48 |
-0.14 |
0 |
|
|
130473 |
51090923 |
2 |
NOF2C8H10 |
ABC2D8E10 |
-279.11 |
2.39 |
-9.09 |
-0.31 |
0 |
|
|
130474 |
51090927 |
3 |
FNOC5H6 |
ABCD5E6 |
-201.72 |
7.09 |
-9.6 |
-1.5 |
0 |
|
|
130475 |
51090928 |
1 |
OF3N4C15H17 |
AB3C4D15E17 |
-150.87 |
7.82 |
-9.31 |
-0.83 |
0 |
|
|
130476 |
51090929 |
3 |
FNOC5H6 |
ABCD5E6 |
-202.55 |
5.92 |
-9.44 |
-1.68 |
0 |
|
|
130477 |
51090930 |
1 |
N2F3O3C16H21 |
A2B3C3D16E21 |
-264.19 |
4.05 |
-8.67 |
-0.28 |
0 |
|
|
130478 |
51090934 |
1 |
N2F3O3C16H21 |
A2B3C3D16E21 |
-262.26 |
8.94 |
-8.91 |
-0.55 |
0 |
|
|
130479 |
51090935 |
1 |
N2F3O3C16H21 |
A2B3C3D16E21 |
-272.91 |
9.01 |
-9.26 |
-0.3 |
0 |
|
|
130480 |
51090939 |
1 |
ON2F3C18H19 |
AB2C3D18E19 |
-171.27 |
6.81 |
-9.3 |
-0.9 |
0 |
|
|
130481 |
51090940 |
1 |
OF3N3C17H20 |
AB3C3D17E20 |
-180.22 |
8.0 |
-8.8 |
-0.33 |
0 |
|
|
130482 |
51090941 |
1 |
ON2F3C18H27 |
AB2C3D18E27 |
-244.63 |
6.7 |
-9.38 |
0.98 |
0 |
|
|
130483 |
51090942 |
1 |
ON4C15H26 |
AB4C15D26 |
-36.04 |
4.39 |
-8.71 |
0.24 |
0 |
|
|
130484 |
51090943 |
1 |
FN2O3C19H25 |
AB2C3D19E25 |
-153.37 |
9.26 |
-9.11 |
-0.43 |
0 |
|
|
130485 |
51090944 |
2 |
NOC10H13 |
ABC10D13 |
-56.12 |
3.73 |
-8.66 |
-0.54 |
0 |
|
|
130486 |
51090945 |
1 |
ON3C20H27 |
AB3C20D27 |
-26.51 |
3.94 |
-8.54 |
-0.15 |
0 |
|
|
130487 |
51090948 |
1 |
ON2C21H26 |
AB2C21D26 |
-17.01 |
5.0 |
-8.7 |
-0.59 |
0 |
|
|
130488 |
51090949 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-23.32 |
8.94 |
-8.95 |
-0.94 |
0 |
|
|
130489 |
51090952 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-46.74 |
5.9 |
-8.85 |
-0.6 |
0 |
|
|
130490 |
51090953 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-112.1 |
4.17 |
-8.73 |
0.1 |
0 |
|
|
130491 |
51090956 |
1 |
FSN2O3C15H21 |
ABC2D3E15F21 |
-168.24 |
8.18 |
-9.5 |
-0.06 |
0 |
|
|
130492 |
51090957 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-132.05 |
4.45 |
-9.25 |
-0.61 |
0 |
|
|
130493 |
51090958 |
1 |
SN3O3C15H23 |
AB3C3D15E23 |
-139.34 |
4.77 |
-9.13 |
-0.2 |
0 |
|
|
130494 |
51090959 |
1 |
N2O3C18H24 |
A2B3C18D24 |
-129.09 |
3.05 |
-8.77 |
0.25 |
0 |
|
|
130495 |
51090961 |
1 |
O3N4C14H16 |
A3B4C14D16 |
-20.09 |
3.52 |
-8.73 |
-0.75 |
0 |
|
|
130496 |
51090962 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-145.01 |
4.51 |
-9.2 |
0.7 |
0 |
|
|
130497 |
51090967 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-83.32 |
5.25 |
-8.97 |
-0.75 |
0 |
|
|
130498 |
51090968 |
1 |
N3O4C16H21 |
A3B4C16D21 |
-158.13 |
4.98 |
-9.12 |
-0.68 |
0 |
|
|
130499 |
51090973 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-67.24 |
2.65 |
-9.41 |
-0.41 |
0 |
|
|
130500 |
51090974 |
1 |
SN3O3C17H21 |
AB3C3D17E21 |
-74.03 |
3.51 |
-9.4 |
-0.94 |
0 |
|
|
130501 |
51090976 |
1 |
O2N3C19H21 |
A2B3C19D21 |
-10.29 |
6.62 |
-8.76 |
-0.38 |
0 |
|
|
130502 |
51090977 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-107.74 |
3.45 |
-9.43 |
-0.62 |
0 |
|
|
130503 |
51090978 |
1 |
N3O4C17H19 |
A3B4C17D19 |
-41.27 |
3.18 |
-9.89 |
-1.43 |
0 |
|
|
130504 |
51090980 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-79.88 |
1.5 |
-8.93 |
-0.59 |
0 |
|
|
130505 |
51090983 |
1 |
N2O2C21H28 |
A2B2C21D28 |
-69.65 |
7.62 |
-9.03 |
-0.14 |
0 |
|
|
130506 |
51090985 |
3 |
NOC6H9 |
ABC6D9 |
-51.98 |
6.74 |
-8.81 |
-1.35 |
0 |