List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
24859 |
613928 |
3 |
OC6H6 |
AB6C6 |
-56.12 |
4.07 |
-9.22 |
-0.61 |
0 |
|
|
24860 |
613930 |
2 |
O4C13H20 |
A4B13C20 |
-320.61 |
6.69 |
-10.04 |
-0.37 |
0 |
|
|
24861 |
613937 |
1 |
OSeH10C11 |
ABC10D11 |
-15.27 |
3.26 |
-8.65 |
-0.44 |
0 |
|
|
24862 |
613991 |
1 |
NSO3H9C10 |
ABC3D9E10 |
-57.86 |
3.03 |
-8.82 |
-1.42 |
0 |
|
|
24863 |
613999 |
1 |
N5H9C12 |
A5B9C12 |
111.46 |
4.6 |
-8.7 |
-0.82 |
0 |
|
|
24864 |
614025 |
1 |
BrOSN2C9H13 |
ABCD2E9F13 |
-38.49 |
3.47 |
-9.3 |
-0.93 |
0 |
|
|
24865 |
614033 |
1 |
N3H13C14 |
A3B13C14 |
96.49 |
4.31 |
-8.05 |
-0.58 |
0 |
|
|
24866 |
614035 |
1 |
NOH13C15 |
ABC13D15 |
29.42 |
4.97 |
-9.61 |
-0.96 |
0 |
|
|
24867 |
614061 |
1 |
N2C15H16 |
A2B15C16 |
55.99 |
6.42 |
-8.23 |
-0.22 |
0 |
|
|
24868 |
614142 |
1 |
N2O3C21H42 |
A2B3C21D42 |
-203.67 |
3.81 |
-9.21 |
0.77 |
0 |
|
|
24869 |
614145 |
1 |
OPSC11H13 |
ABCD11E13 |
-68.75 |
4.74 |
-8.87 |
-0.46 |
0 |
|
|
24870 |
614146 |
1 |
ON3H13C14 |
AB3C13D14 |
12.79 |
4.9 |
-9.62 |
-1.3 |
0 |
|
|
24871 |
614170 |
1 |
ON2H12C14 |
AB2C12D14 |
31.51 |
5.35 |
-8.78 |
-0.6 |
0 |
|
|
24872 |
614172 |
1 |
ON2C21H26 |
AB2C21D26 |
9.12 |
3.01 |
-9.0 |
0.35 |
0 |
|
|
24873 |
614192 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-75.49 |
4.67 |
-9.09 |
-0.78 |
0 |
|
|
24874 |
614193 |
1 |
FO3C12H13 |
AB3C12D13 |
-138.32 |
2.03 |
-8.93 |
-0.52 |
0 |
|
|
24875 |
614194 |
1 |
OC16H16 |
AB16C16 |
19.92 |
1.79 |
-8.69 |
0.24 |
0 |
|
|
24876 |
614195 |
1 |
ON2H12C14 |
AB2C12D14 |
40.07 |
3.6 |
-10.16 |
-1.14 |
0 |
|
|
24877 |
614196 |
2 |
NO2C5H6 |
AB2C5D6 |
-129.07 |
0.17 |
-8.02 |
-0.35 |
0 |
|
|
24878 |
614198 |
2 |
NO2C12H23 |
AB2C12D23 |
-260.32 |
1.95 |
-9.27 |
0.7 |
0 |
|
|
24879 |
614200 |
1 |
N3O4C10H13 |
A3B4C10D13 |
-19.71 |
3.34 |
-9.71 |
-1.88 |
0 |
|
|
24880 |
614215 |
1 |
S3H8C10 |
A3B8C10 |
68.05 |
4.41 |
-8.55 |
-1.3 |
0 |
|
|
24881 |
614218 |
1 |
BrNO3C16H16 |
ABC3D16E16 |
-96.24 |
3.83 |
-9.36 |
-0.54 |
0 |
|
|
24882 |
614219 |
1 |
BrNO3C16H16 |
ABC3D16E16 |
-97.97 |
4.55 |
-9.52 |
-0.56 |
0 |
|
|
24883 |
614223 |
1 |
N2O2H8C13 |
A2B2C8D13 |
5.28 |
2.74 |
-9.91 |
-1.77 |
0 |
|
|
24884 |
614227 |
1 |
SN2O2C13H16 |
AB2C2D13E16 |
-42.73 |
7.0 |
-9.49 |
-0.6 |
0 |
|
|
24885 |
614229 |
1 |
ClFSN2O3H14C16 |
ABCD2E3F14G16 |
-133.28 |
8.24 |
-8.91 |
-0.9 |
0 |
|
|
24886 |
614241 |
1 |
ON4H8C12 |
AB4C8D12 |
68.41 |
9.28 |
-9.29 |
-1.32 |
0 |
|
|
24887 |
614243 |
1 |
O3C13H20 |
A3B13C20 |
-165.13 |
3.87 |
-10.14 |
0.33 |
0 |
|
|
24888 |
614244 |
1 |
SN5H15C21 |
AB5C15D21 |
176.3 |
6.84 |
-9.22 |
-1.23 |
0 |
|
|
24889 |
614248 |
1 |
ClNO2H18C21 |
ABC2D18E21 |
-28.07 |
3.04 |
-8.82 |
-0.6 |
0 |
|
|
24890 |
614253 |
1 |
FNSO3C17H18 |
ABCD3E17F18 |
-122.92 |
6.25 |
-8.87 |
-0.64 |
0 |
|
|
24891 |
614259 |
1 |
BO2H13C14 |
AB2C13D14 |
-94.24 |
0.83 |
-8.76 |
-0.47 |
0 |
|
|
24892 |
614260 |
1 |
ON2H12C14 |
AB2C12D14 |
40.03 |
2.69 |
-9.88 |
-1.3 |
0 |
|
|
24893 |
614261 |
1 |
ON2H12C14 |
AB2C12D14 |
39.18 |
1.35 |
-8.66 |
-1.29 |
0 |
|
|
24894 |
614262 |
2 |
OSN2C3 |
ABC2D3 |
76.19 |
0.02 |
-10.34 |
-2.03 |
0 |
|
|
24895 |
614263 |
1 |
ClSN3O3H14C16 |
ABC3D3E14F16 |
-55.87 |
3.41 |
-9.34 |
-1.33 |
0 |
|
|
24896 |
614265 |
1 |
O4H12C15 |
A4B12C15 |
-113.5 |
5.18 |
-9.32 |
-1.01 |
0 |
|
|
24897 |
614271 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-38.39 |
2.15 |
-9.1 |
-0.51 |
0 |
|
|
24898 |
614273 |
1 |
SN2O2C19H26 |
AB2C2D19E26 |
-102.61 |
1.21 |
-8.4 |
-0.32 |
0 |
|
|
24899 |
614294 |
1 |
ON2C18H20 |
AB2C18D20 |
12.67 |
3.08 |
-8.19 |
-0.42 |
0 |
|
|
24900 |
614297 |
1 |
N4H12C13 |
A4B12C13 |
95.62 |
4.7 |
-9.21 |
-0.96 |
0 |
|
|
24901 |
614298 |
1 |
N4H12C13 |
A4B12C13 |
60.87 |
1.86 |
-8.45 |
-0.59 |
0 |
|
|
24902 |
614307 |
1 |
SiO2C15H16 |
AB2C15D16 |
-106.12 |
3.06 |
-8.74 |
0.4 |
0 |
|
|
24903 |
614361 |
1 |
SO2N5C7H7 |
AB2C5D7E7 |
4.56 |
2.55 |
-9.13 |
-2.06 |
0 |
|
|
24904 |
614368 |
1 |
N3O4C9H11 |
A3B4C9D11 |
-114.17 |
3.69 |
-9.44 |
-1.11 |
0 |
|
|
24905 |
614375 |
1 |
SSiO2C10H14 |
ABC2D10E14 |
-122.44 |
3.75 |
-8.82 |
-0.84 |
0 |
|
|
24906 |
614377 |
1 |
PSN2Si2O3C10H25 |
ABC2D2E3F10G25 |
-337.99 |
3.62 |
-8.72 |
-0.81 |
0 |
|
|
24907 |
614462 |
1 |
NO5C27H45 |
AB5C27D45 |
-249.73 |
2.76 |
-8.78 |
-0.27 |
0 |
|
|
24908 |
614463 |
1 |
N2O3C15H16 |
A2B3C15D16 |
-48.1 |
2.26 |
-8.9 |
-0.34 |
0 |
|
|
24909 |
614464 |
1 |
NO6C29H49 |
AB6C29D49 |
-305.67 |
2.89 |
-8.68 |
-0.17 |
0 |
|
|
24910 |
614465 |
1 |
OSiC14H28 |
ABC14D28 |
-146.25 |
1.94 |
-8.87 |
1.47 |
0 |
|
|
24911 |
614467 |
1 |
NO2S2H7C9 |
AB2C2D7E9 |
-27.49 |
7.29 |
-9.4 |
-1.66 |
0 |
|
|
24912 |
614469 |
2 |
NOC2Cl3 |
ABC2D3 |
16.91 |
0.47 |
-10.89 |
-2.01 |
0 |
|
|
24913 |
614470 |
1 |
OSH16C17 |
ABC16D17 |
5.79 |
4.09 |
-9.21 |
-0.39 |
0 |
|
|
24914 |
614471 |
1 |
O2N5C9H15 |
A2B5C9D15 |
-24.88 |
4.6 |
-9.69 |
-0.61 |
0 |
|
|
24915 |
614477 |
1 |
SN4O8C18H22 |
AB4C8D18E22 |
-290.89 |
1.24 |
-8.86 |
-0.82 |
0 |
|
|
24916 |
614479 |
1 |
FNOH8C14 |
ABCD8E14 |
0.18 |
3.63 |
-9.27 |
-1.91 |
0 |
|
|
24917 |
614485 |
2 |
O2C13H21 |
A2B13C21 |
-215.59 |
4.56 |
-10.1 |
-0.83 |
0 |
|
|
24918 |
614486 |
1 |
SN2O5C17H18 |
AB2C5D17E18 |
-148.88 |
2.51 |
-8.23 |
-0.83 |
0 |
|
|
24919 |
614490 |
1 |
ClOH11C16 |
ABC11D16 |
43.74 |
2.02 |
-8.48 |
-1.33 |
0 |
|
|
24920 |
614492 |
1 |
NOS2C10H11 |
ABC2D10E11 |
26.12 |
2.2 |
-8.34 |
-0.56 |
0 |
|
|
24921 |
614605 |
1 |
NO5C18H19 |
AB5C18D19 |
-166.89 |
1.56 |
-8.68 |
-0.11 |
0 |
|
|
24922 |
614606 |
1 |
BrNO4C35H48 |
ABC4D35E48 |
-192.2 |
2.72 |
-8.54 |
-0.74 |
0 |
|
|
24923 |
614607 |
1 |
O2N3C16H17 |
A2B3C16D17 |
-3.05 |
9.05 |
-8.62 |
-1.15 |
0 |
|
|
24924 |
614611 |
2 |
NOH5C6F7 |
ABC5D6E7 |
-797.92 |
4.88 |
-10.8 |
-0.46 |
0 |
|
|
24925 |
614612 |
1 |
NO7C30H59 |
AB7C30D59 |
-405.37 |
5.04 |
-9.42 |
0.52 |
0 |
|
|
24926 |
614616 |
1 |
NSO6C18H23 |
ABC6D18E23 |
-162.02 |
4.23 |
-8.74 |
-0.62 |
0 |
|
|
24927 |
614623 |
1 |
NSiO3C13H23 |
ABC3D13E23 |
-136.0 |
3.14 |
-9.58 |
0.33 |
0 |
|
|
24928 |
614628 |
2 |
NO2C8H15 |
AB2C8D15 |
-218.48 |
0.56 |
-9.57 |
0.88 |
0 |
|
|
24929 |
614714 |
1 |
N2F3H9C11 |
A2B3C9D11 |
-114.59 |
6.61 |
-9.19 |
-0.6 |
0 |
|
|
24930 |
614894 |
1 |
NOF7C16H26 |
ABC7D16E26 |
-451.05 |
5.0 |
-10.66 |
-0.2 |
0 |
|
|
24931 |
614903 |
1 |
CuN2O2F6H14C16 |
AB2C2D6E14F16 |
-295.11 |
9.48 |
0.0 |
0.0 |
0 |
|
|
24932 |
614942 |
2 |
OC8H9 |
AB8C9 |
-51.31 |
2.86 |
-8.62 |
0.21 |
0 |
|
|
24933 |
614956 |
2 |
NO2C8H10 |
AB2C8D10 |
-156.65 |
2.62 |
-9.35 |
-0.49 |
0 |