List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
208895 |
80601102 |
1 |
BrSN2O2C13H17 |
ABC2D2E13F17 |
3.02 |
8.0 |
-8.8 |
-1.5 |
0 |
|
|
208896 |
80601103 |
1 |
OSN2C15H22 |
ABC2D15E22 |
-43.22 |
4.51 |
-8.44 |
0.1 |
0 |
|
|
208897 |
80601104 |
1 |
SN3C12H21 |
AB3C12D21 |
12.22 |
5.74 |
-8.73 |
0.41 |
0 |
|
|
208898 |
80601105 |
1 |
BrOSN2C12H17 |
ABCD2E12F17 |
-36.23 |
3.05 |
-8.83 |
-0.02 |
0 |
|
|
208899 |
80601106 |
1 |
NSC14H25 |
ABC14D25 |
-24.15 |
1.18 |
-8.51 |
0.85 |
0 |
|
|
208900 |
80601107 |
1 |
BrNSO2C11H14 |
ABCD2E11F14 |
-57.61 |
2.31 |
-8.73 |
-0.82 |
0 |
|
|
208901 |
80601215 |
1 |
O2S2N4C11H18 |
A2B2C4D11E18 |
-36.04 |
4.85 |
-8.84 |
-0.94 |
0 |
|
|
208902 |
80601248 |
1 |
NS2C13H21 |
AB2C13D21 |
-2.83 |
3.26 |
-8.56 |
0.0 |
0 |
|
|
208903 |
80601372 |
1 |
BrFOC16H20 |
ABCD16E20 |
-87.7 |
4.02 |
-9.58 |
-0.43 |
0 |
|
|
208904 |
80601768 |
1 |
BrOSN2H9C12 |
ABCD2E9F12 |
50.04 |
4.03 |
-9.46 |
-0.99 |
0 |
|
|
208905 |
80602810 |
1 |
BrNOC17H26 |
ABCD17E26 |
-36.09 |
1.77 |
-8.76 |
-0.14 |
0 |
|
|
208906 |
80602811 |
1 |
NC15H29 |
AB15C29 |
-46.22 |
1.69 |
-9.21 |
3.5 |
0 |
|
|
208907 |
80602812 |
1 |
NOC16H33 |
ABC16D33 |
-94.12 |
1.45 |
-9.23 |
2.2 |
0 |
|
|
208908 |
80602824 |
2 |
NO2C6H7 |
AB2C6D7 |
-68.44 |
10.86 |
-9.91 |
-1.32 |
0 |
|
|
208909 |
80602883 |
1 |
NOC17H33 |
ABC17D33 |
-100.78 |
3.36 |
-9.35 |
2.95 |
0 |
|
|
208910 |
80603326 |
1 |
NC16H33 |
AB16C33 |
-59.93 |
2.05 |
-8.96 |
3.52 |
0 |
|
|
208911 |
80603327 |
1 |
NC13H27 |
AB13C27 |
-47.24 |
2.03 |
-9.0 |
3.54 |
0 |
|
|
208912 |
80603328 |
1 |
BrFOC16H22 |
ABCD16E22 |
-104.2 |
2.62 |
-9.54 |
-0.26 |
0 |
|
|
208913 |
80603329 |
1 |
ON2C15H26 |
AB2C15D26 |
-45.42 |
2.65 |
-9.55 |
0.6 |
0 |
|
|
208914 |
80603388 |
1 |
NC19H39 |
AB19C39 |
-76.63 |
1.48 |
-8.71 |
3.11 |
0 |
|
|
208915 |
80603559 |
1 |
BrClN2C15H20 |
ABC2D15E20 |
26.63 |
2.27 |
-9.96 |
-0.94 |
0 |
|
|
208916 |
80603560 |
1 |
ClIN2C16H24 |
ABC2D16E24 |
1.19 |
2.03 |
-9.73 |
-1.33 |
0 |
|
|
208917 |
80603561 |
1 |
NCl2C16H23 |
AB2C16D23 |
-25.72 |
4.04 |
-9.22 |
-0.15 |
0 |
|
|
208918 |
80603992 |
1 |
OC17H34 |
AB17C34 |
-120.29 |
2.04 |
-10.12 |
2.9 |
0 |
|
|
208919 |
80604043 |
1 |
NOF2C16H23 |
ABC2D16E23 |
-134.94 |
2.66 |
-9.45 |
-0.59 |
0 |
|
|
208920 |
80604400 |
1 |
NF2C11H15 |
AB2C11D15 |
-91.7 |
2.23 |
-9.22 |
0.43 |
0 |
|
|
208921 |
80604401 |
1 |
NF2C7H13 |
AB2C7D13 |
-98.33 |
2.46 |
-9.38 |
1.99 |
0 |
|
|
208922 |
80604402 |
1 |
NF2C8H15 |
AB2C8D15 |
-103.24 |
2.58 |
-9.4 |
1.98 |
0 |
|
|
208923 |
80604619 |
2 |
FOC5H6 |
ABC5D6 |
-176.04 |
2.45 |
-8.98 |
0.11 |
0 |
|
|
208924 |
80604849 |
1 |
F2N2O2S2H8C11 |
A2B2C2D2E8F11 |
-90.97 |
1.55 |
-9.31 |
-1.73 |
0 |
|
|
208925 |
80605237 |
1 |
NF4C9H9 |
AB4C9D9 |
-173.87 |
2.25 |
-9.78 |
-0.57 |
0 |
|
|
208926 |
80605364 |
1 |
NF2O3C9H9 |
AB2C3D9E9 |
-135.66 |
4.68 |
-10.61 |
-1.53 |
0 |
|
|
208927 |
80605421 |
1 |
NF2C12H23 |
AB2C12D23 |
-141.72 |
1.75 |
-9.01 |
2.33 |
0 |
|
|
208928 |
80605422 |
1 |
NF2C10H21 |
AB2C10D21 |
-144.02 |
3.2 |
-9.36 |
2.25 |
0 |
|
|
208929 |
80605423 |
1 |
NF2C10H21 |
AB2C10D21 |
-143.21 |
2.85 |
-9.26 |
2.22 |
0 |
|
|
208930 |
80605517 |
1 |
NOF2C11H21 |
ABC2D11E21 |
-174.16 |
2.72 |
-9.36 |
2.07 |
0 |
|
|
208931 |
80605518 |
1 |
NOF2C8H15 |
ABC2D8E15 |
-163.22 |
2.21 |
-9.2 |
1.93 |
0 |
|
|
208932 |
80605622 |
1 |
NF2C7H13 |
AB2C7D13 |
-120.1 |
2.58 |
-9.36 |
2.34 |
0 |
|
|
208933 |
80605623 |
1 |
NF2C12H17 |
AB2C12D17 |
-88.83 |
3.9 |
-9.23 |
0.38 |
0 |
|
|
208934 |
80605624 |
1 |
NSF2O2C11H15 |
ABC2D2E11F15 |
-170.52 |
4.52 |
-9.81 |
-0.69 |
0 |
|
|
208935 |
80605625 |
1 |
NF2C8H17 |
AB2C8D17 |
-132.09 |
3.25 |
-9.42 |
2.31 |
0 |
|
|
208936 |
80605626 |
1 |
NF2C8H15 |
AB2C8D15 |
-124.98 |
1.77 |
-9.25 |
2.3 |
0 |
|
|
208937 |
80605627 |
1 |
NOF2C11H15 |
ABC2D11E15 |
-130.99 |
3.54 |
-8.7 |
0.2 |
0 |
|
|
208938 |
80605628 |
1 |
NOF2C6H13 |
ABC2D6E13 |
-155.76 |
2.17 |
-9.19 |
1.71 |
0 |
|
|
208939 |
80605629 |
1 |
NF2O2C13H17 |
AB2C2D13E17 |
-163.84 |
2.08 |
-8.78 |
0.04 |
0 |
|
|
208940 |
80605630 |
1 |
NOF3C10H12 |
ABC3D10E12 |
-164.88 |
3.93 |
-9.02 |
-0.14 |
0 |
|
|
208941 |
80605631 |
1 |
NF2C15H21 |
AB2C15D21 |
-102.67 |
2.28 |
-9.12 |
0.49 |
0 |
|
|
208942 |
80606185 |
1 |
OSN4C10H18 |
ABC4D10E18 |
-4.93 |
2.95 |
-8.98 |
-0.81 |
0 |
|
|
208943 |
80606281 |
1 |
OSN4C12H22 |
ABC4D12E22 |
-16.77 |
4.83 |
-8.88 |
-0.84 |
0 |
|
|
208944 |
80606282 |
1 |
SO2N4C11H18 |
AB2C4D11E18 |
-53.13 |
2.75 |
-9.21 |
-0.48 |
0 |