List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
27923 |
824166 |
1 |
ClO2N3C17H18 |
AB2C3D17E18 |
-5.54 |
4.06 |
-8.8 |
-1.0 |
0 |
|
|
27924 |
824167 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-56.77 |
0.34 |
-9.17 |
0.15 |
0 |
|
|
27925 |
824168 |
1 |
O3N4H14C17 |
A3B4C14D17 |
55.23 |
9.57 |
-8.51 |
-1.42 |
0 |
|
|
27926 |
824169 |
2 |
NOH10C11 |
ABC10D11 |
1.11 |
1.86 |
-9.49 |
-0.63 |
0 |
|
|
27927 |
824176 |
1 |
BrN3O3H10C14 |
AB3C3D10E14 |
45.99 |
4.43 |
-9.32 |
-1.6 |
0 |
|
|
27928 |
824182 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-104.87 |
5.88 |
-9.09 |
-0.96 |
0 |
|
|
27929 |
824184 |
1 |
N2O3C17H22 |
A2B3C17D22 |
-98.51 |
1.86 |
-8.47 |
0.08 |
0 |
|
|
27930 |
824187 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-13.16 |
6.12 |
-9.35 |
-1.4 |
0 |
|
|
27931 |
824190 |
1 |
N3O3H15C16 |
A3B3C15D16 |
21.33 |
4.84 |
-9.4 |
-1.37 |
0 |
|
|
27932 |
824191 |
1 |
N3O3C12H13 |
A3B3C12D13 |
-1.26 |
5.87 |
-9.45 |
-1.4 |
0 |
|
|
27933 |
824192 |
1 |
N3O4H15C16 |
A3B4C15D16 |
-8.37 |
5.29 |
-8.89 |
-1.36 |
0 |
|
|
27934 |
824193 |
1 |
O3N4C15H18 |
A3B4C15D18 |
-55.27 |
7.69 |
-8.49 |
-0.51 |
0 |
|
|
27935 |
824197 |
1 |
O3N5C15H17 |
A3B5C15D17 |
34.61 |
10.21 |
-9.32 |
-1.25 |
0 |
|
|
27936 |
824198 |
2 |
ON2C9H11 |
AB2C9D11 |
3.0 |
8.0 |
-8.49 |
-0.52 |
0 |
|
|
27937 |
824204 |
1 |
BrON2H15C17 |
ABC2D15E17 |
39.54 |
11.28 |
-8.45 |
-1.7 |
0 |
|
|
27938 |
824205 |
1 |
BrON2H15C17 |
ABC2D15E17 |
38.38 |
10.91 |
-8.43 |
-1.63 |
0 |
|
|
27939 |
824211 |
1 |
BrNOH12C14 |
ABCD12E14 |
19.18 |
1.75 |
-8.88 |
-0.68 |
0 |
|
|
27940 |
824213 |
1 |
BrNOH12C14 |
ABCD12E14 |
1.47 |
5.16 |
-8.84 |
-0.58 |
0 |
|
|
27941 |
824215 |
1 |
NO2C20H21 |
AB2C20D21 |
-17.93 |
3.03 |
-9.32 |
0.0 |
0 |
|
|
27942 |
824218 |
1 |
NO4H9C15 |
AB4C9D15 |
-5.89 |
2.42 |
-9.18 |
-2.05 |
0 |
|
|
27943 |
824228 |
2 |
NOC8H10 |
ABC8D10 |
-31.83 |
1.27 |
-9.42 |
0.22 |
0 |
|
|
27944 |
824235 |
1 |
N3O4H15C17 |
A3B4C15D17 |
16.8 |
1.31 |
-9.35 |
-0.99 |
0 |
|
|
27945 |
824240 |
1 |
SN2O3C14H16 |
AB2C3D14E16 |
-103.63 |
4.52 |
-8.82 |
-0.78 |
0 |
|
|
27946 |
824263 |
2 |
NOH7C9 |
ABC7D9 |
56.26 |
6.99 |
-8.82 |
-1.16 |
0 |
|
|
27947 |
824268 |
1 |
ClSN3O3C14H18 |
ABC3D3E14F18 |
-93.42 |
6.28 |
-9.43 |
-0.88 |
0 |
|
|
27948 |
824270 |
1 |
NO2Cl3H12C15 |
AB2C3D12E15 |
-55.14 |
1.78 |
-9.36 |
-1.0 |
0 |
|
|
27949 |
824274 |
1 |
NO6H11C13 |
AB6C11D13 |
-137.14 |
5.17 |
-10.93 |
-1.73 |
0 |
|
|
27950 |
824284 |
1 |
ClN3O4H8C14 |
AB3C4D8E14 |
19.21 |
1.4 |
-9.11 |
-2.14 |
0 |
|
|
27951 |
824295 |
1 |
SO2N3C13H13 |
AB2C3D13E13 |
-30.6 |
3.0 |
-9.28 |
-1.04 |
0 |
|
|
27952 |
824296 |
1 |
NO2H19C23 |
AB2C19D23 |
4.18 |
2.78 |
-8.38 |
-1.35 |
0 |
|
|
27953 |
824314 |
1 |
ON2Cl3C13H17 |
AB2C3D13E17 |
-65.94 |
4.17 |
-9.65 |
-0.45 |
0 |
|
|
27954 |
824323 |
1 |
ClNOC18H22 |
ABCD18E22 |
-35.92 |
1.65 |
-8.43 |
-0.44 |
0 |
|
|
27955 |
824325 |
1 |
NS2O3H13C14 |
AB2C3D13E14 |
-56.3 |
1.67 |
-9.18 |
-1.33 |
0 |
|
|
27956 |
824327 |
1 |
FNO2H18C20 |
ABC2D18E20 |
-53.8 |
2.51 |
-9.42 |
-1.34 |
0 |
|
|
27957 |
824333 |
1 |
BrOSN3C13H16 |
ABCD3E13F16 |
30.82 |
5.46 |
-8.75 |
-1.08 |
0 |
|
|
27958 |
824338 |
1 |
FN2O2H15C17 |
AB2C2D15E17 |
-84.64 |
1.19 |
-9.12 |
-0.43 |
0 |
|
|
27959 |
824339 |
1 |
FN2O2H15C17 |
AB2C2D15E17 |
-84.74 |
1.31 |
-9.11 |
-0.43 |
0 |
|
|
27960 |
824340 |
1 |
ON2H12C16 |
AB2C12D16 |
33.34 |
6.18 |
-9.41 |
-1.04 |
0 |
|
|
27961 |
824341 |
1 |
FN2O2C19H19 |
AB2C2D19E19 |
-93.81 |
7.14 |
-8.84 |
-0.19 |
0 |
|
|
27962 |
824342 |
1 |
FN2O2C19H19 |
AB2C2D19E19 |
-94.74 |
1.4 |
-9.02 |
-0.35 |
0 |
|
|
27963 |
824361 |
1 |
N2O3H12C13 |
A2B3C12D13 |
-37.16 |
5.31 |
-8.64 |
-0.64 |
0 |
|
|
27964 |
824372 |
1 |
NCl3H12C14 |
AB3C12D14 |
14.9 |
2.35 |
-9.14 |
-0.92 |
0 |
|
|
27965 |
824373 |
1 |
NCl2C15H15 |
AB2C15D15 |
11.51 |
1.89 |
-9.03 |
-0.78 |
0 |
|
|
27966 |
824374 |
1 |
NCl2C15H15 |
AB2C15D15 |
10.33 |
1.32 |
-8.98 |
-0.73 |
0 |
|
|
27967 |
824468 |
1 |
OSCl2N2H12C15 |
ABC2D2E12F15 |
21.4 |
3.45 |
-9.04 |
-0.91 |
0 |
|
|
27968 |
824470 |
1 |
ClSN2O2H13C15 |
ABC2D2E13F15 |
-13.2 |
1.16 |
-8.8 |
-0.67 |
0 |
|
|
27969 |
824472 |
1 |
ClSN2O2C17H17 |
ABC2D2E17F17 |
-18.98 |
6.69 |
-8.74 |
-0.54 |
0 |
|
|
27970 |
824478 |
1 |
ClOSN2H13C15 |
ABCD2E13F15 |
18.18 |
3.83 |
-8.76 |
-1.03 |
0 |
|
|
27971 |
824480 |
1 |
ClNOSH16C19 |
ABCDE16F19 |
6.62 |
1.43 |
-8.64 |
-0.65 |
0 |
|
|
27972 |
824488 |
1 |
SN2O2C16H16 |
AB2C2D16E16 |
-15.32 |
5.65 |
-8.51 |
-0.64 |
0 |