List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
20844 |
586099 |
2 |
NC10H13 |
AB10C13 |
43.39 |
2.73 |
-8.47 |
0.5 |
0 |
|
|
20845 |
586102 |
1 |
O3C16H20 |
A3B16C20 |
-99.96 |
1.65 |
-8.5 |
-0.01 |
0 |
|
|
20846 |
586117 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-122.18 |
3.81 |
-8.24 |
0.12 |
0 |
|
|
20847 |
586120 |
1 |
OSnN2C37H38 |
ABC2D37E38 |
95.26 |
4.41 |
-9.04 |
-0.57 |
0 |
|
|
20848 |
586121 |
1 |
ON2C19H24 |
AB2C19D24 |
-7.07 |
1.87 |
-7.98 |
0.34 |
0 |
|
|
20849 |
586127 |
1 |
SN5O5C18H25 |
AB5C5D18E25 |
-175.47 |
2.47 |
-8.88 |
-0.38 |
0 |
|
|
20850 |
586133 |
1 |
ClN2O3C20H21 |
AB2C3D20E21 |
-96.52 |
2.14 |
-8.37 |
-0.22 |
0 |
|
|
20851 |
586134 |
1 |
Cl2N2O3H16C18 |
A2B2C3D16E18 |
-92.74 |
4.65 |
-8.62 |
-0.7 |
0 |
|
|
20852 |
586151 |
1 |
O2C11H16 |
A2B11C16 |
-87.03 |
5.67 |
-10.45 |
-0.1 |
0 |
|
|
20853 |
586152 |
1 |
OSC10H12 |
ABC10D12 |
-8.22 |
2.65 |
-9.22 |
-0.37 |
0 |
|
|
20854 |
586156 |
1 |
C5N5H7 |
A5B5C7 |
61.9 |
1.28 |
-9.66 |
-0.47 |
0 |
|
|
20855 |
586157 |
1 |
N3O3C16H23 |
A3B3C16D23 |
-106.68 |
4.36 |
-8.51 |
-0.05 |
0 |
|
|
20856 |
586167 |
1 |
O5C12H14 |
A5B12C14 |
-190.33 |
3.16 |
-9.13 |
-0.24 |
0 |
|
|
20857 |
586169 |
2 |
OC7H10 |
AB7C10 |
-77.99 |
3.47 |
-8.74 |
0.1 |
0 |
|
|
20858 |
586171 |
1 |
O7C20H26 |
A7B20C26 |
-300.1 |
4.14 |
-10.34 |
0.16 |
0 |
|
|
20859 |
586173 |
1 |
S2C15H16 |
A2B15C16 |
40.96 |
3.15 |
-8.67 |
-0.27 |
0 |
|
|
20860 |
586181 |
1 |
O4C13H24 |
A4B13C24 |
-220.35 |
3.39 |
-10.78 |
0.7 |
0 |
|
|
20861 |
586185 |
1 |
O3N5C17H23 |
A3B5C17D23 |
-73.44 |
4.55 |
-8.91 |
-0.57 |
0 |
|
|
20862 |
586191 |
1 |
OC10H16 |
AB10C16 |
-37.21 |
4.15 |
-9.45 |
0.78 |
0 |
|
|
20863 |
586192 |
2 |
OC11H16 |
AB11C16 |
-95.96 |
2.67 |
-8.89 |
0.47 |
0 |
|
|
20864 |
586193 |
1 |
SN3O3H9C10 |
AB3C3D9E10 |
-55.02 |
0.52 |
-9.41 |
-1.03 |
0 |
|
|
20865 |
586208 |
1 |
OSN3C15H15 |
ABC3D15E15 |
26.31 |
2.98 |
-9.03 |
-0.94 |
0 |
|
|
20866 |
586216 |
1 |
OS2C14H26 |
AB2C14D26 |
-65.33 |
4.47 |
-8.17 |
0.5 |
0 |
|
|
20867 |
586218 |
2 |
C10H19 |
A10B19 |
-91.82 |
0.05 |
-10.24 |
3.88 |
0 |
|
|
20868 |
586222 |
1 |
ClOSiC6H15 |
ABCD6E15 |
-150.52 |
3.48 |
-9.85 |
0.58 |
0 |
|
|
20869 |
586227 |
1 |
O2F3N3C16H18 |
A2B3C3D16E18 |
-186.13 |
8.33 |
-9.4 |
-0.63 |
0 |
|
|
20870 |
586238 |
1 |
SO4N5C18H23 |
AB4C5D18E23 |
-90.59 |
12.94 |
-9.1 |
-0.72 |
0 |
|
|
20871 |
586242 |
1 |
NPSC4H12 |
ABCD4E12 |
-71.91 |
6.11 |
-8.71 |
1.18 |
0 |
|
|
20872 |
586252 |
1 |
N2O3H10C12 |
A2B3C10D12 |
-61.75 |
3.54 |
-9.23 |
-0.6 |
0 |
|
|
20873 |
586253 |
1 |
SiO2C27H42 |
AB2C27D42 |
-179.55 |
2.82 |
-8.95 |
0.59 |
0 |
|
|
20874 |
586255 |
1 |
FN3O3H10C13 |
AB3C3D10E13 |
-66.69 |
2.37 |
-9.24 |
-1.27 |
0 |
|
|
20875 |
586256 |
2 |
O3C6H8 |
A3B6C8 |
-260.75 |
3.01 |
-10.6 |
-0.44 |
0 |
|
|
20876 |
586257 |
1 |
BrN2O5C9H11 |
AB2C5D9E11 |
-187.27 |
7.42 |
-9.92 |
-1.24 |
0 |
|
|
20877 |
586258 |
1 |
FON3C12H12 |
ABC3D12E12 |
-37.34 |
3.07 |
-9.1 |
-0.54 |
0 |
|
|
20878 |
586259 |
1 |
NSO2H11C12 |
ABC2D11E12 |
-8.75 |
3.54 |
-9.35 |
-1.04 |
0 |
|
|
20879 |
586260 |
1 |
ON4C10H14 |
AB4C10D14 |
4.38 |
1.41 |
-9.35 |
0.02 |
0 |
|
|
20880 |
586261 |
1 |
PO4C10H23 |
AB4C10D23 |
-264.95 |
3.05 |
-9.85 |
1.02 |
0 |
|
|
20881 |
586262 |
2 |
NOC6H8 |
ABC6D8 |
-44.74 |
4.21 |
-9.59 |
0.51 |
0 |
|
|
20882 |
586263 |
1 |
N2C25H38 |
A2B25C38 |
56.75 |
3.31 |
-8.77 |
1.06 |
0 |
|
|
20883 |
586264 |
1 |
ClN2O2H13C15 |
AB2C2D13E15 |
0.42 |
3.47 |
-9.4 |
-0.7 |
0 |
|
|
20885 |
586269 |
1 |
NO3H7C8 |
AB3C7D8 |
-74.99 |
2.69 |
-10.59 |
-1.71 |
0 |
|
|
20886 |
586270 |
2 |
OC6H9 |
AB6C9 |
-87.29 |
3.34 |
-8.93 |
0.13 |
0 |
|
|
20887 |
586271 |
1 |
O3C17H24 |
A3B17C24 |
-109.67 |
3.69 |
-8.31 |
0.12 |
0 |
|
|
20888 |
586272 |
1 |
O3C10H10 |
A3B10C10 |
-64.08 |
1.69 |
-8.43 |
-0.14 |
0 |
|
|
20889 |
586273 |
1 |
O4C21H28 |
A4B21C28 |
-121.19 |
4.31 |
-9.26 |
-0.56 |
0 |
|
|
20890 |
586274 |
1 |
NO3C21H31 |
AB3C21D31 |
-94.83 |
2.2 |
-8.62 |
0.52 |
0 |
|
|
20891 |
586275 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-82.65 |
2.32 |
-8.15 |
0.22 |
0 |
|
|
20892 |
586277 |
1 |
O2C11H16 |
A2B11C16 |
-87.53 |
2.1 |
-9.12 |
0.59 |
0 |
|
|
20893 |
586279 |
1 |
AsO4C6H15 |
AB4C6D15 |
-169.96 |
3.92 |
-10.34 |
-0.45 |
0 |
|
|
20894 |
586280 |
1 |
N2O5C13H14 |
A2B5C13D14 |
-50.88 |
3.69 |
-9.07 |
-1.03 |
0 |
|
|
20895 |
586281 |
1 |
ClOSC10H11 |
ABCD10E11 |
-28.45 |
3.24 |
-9.04 |
-0.69 |
0 |
|
|
20896 |
586282 |
1 |
ClNSO4H8C13 |
ABCD4E8F13 |
-22.98 |
8.9 |
-9.78 |
-1.81 |
0 |
|
|
20897 |
586283 |
1 |
NSO4H11C14 |
ABC4D11E14 |
-22.21 |
3.27 |
-9.54 |
-1.52 |
0 |
|
|
20898 |
586284 |
1 |
SO4H14C16 |
AB4C14D16 |
-104.36 |
4.52 |
-9.6 |
-1.48 |
0 |
|
|
20899 |
586285 |
1 |
SCl2O2H8C13 |
AB2C2D8E13 |
-25.29 |
1.84 |
-9.48 |
-1.35 |
0 |
|
|
20900 |
586286 |
1 |
NOSF6H9C15 |
ABCD6E9F15 |
-297.89 |
7.62 |
-9.6 |
-1.54 |
0 |
|
|
20901 |
586287 |
1 |
SO2H12C17 |
AB2C12D17 |
6.37 |
3.18 |
-8.72 |
-1.34 |
0 |
|
|
20902 |
586288 |
1 |
ISO2H9C13 |
ABC2D9E13 |
5.36 |
4.72 |
-9.15 |
-1.48 |
0 |
|
|
20903 |
586289 |
1 |
ClSO2H9C13 |
ABC2D9E13 |
-20.44 |
4.84 |
-9.21 |
-1.46 |
0 |
|
|
20904 |
586290 |
1 |
SO2Br3H7C13 |
AB2C3D7E13 |
2.13 |
3.58 |
-9.56 |
-1.41 |
0 |
|
|
20905 |
586291 |
1 |
NSO4H9C13 |
ABC4D9E13 |
-17.2 |
9.43 |
-9.77 |
-1.76 |
0 |
|
|
20906 |
586292 |
1 |
OC10H16 |
AB10C16 |
-52.49 |
2.95 |
-9.17 |
1.29 |
0 |
|
|
20907 |
586294 |
1 |
NO3C10H13 |
AB3C10D13 |
-106.11 |
4.76 |
-8.95 |
0.08 |
0 |
|
|
20908 |
586295 |
2 |
OC6H8 |
AB6C8 |
-58.85 |
1.51 |
-8.71 |
0.29 |
0 |
|
|
20909 |
586296 |
1 |
OC10H16 |
AB10C16 |
-25.57 |
2.71 |
-9.79 |
1.05 |
0 |
|
|
20910 |
586297 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-102.09 |
4.46 |
-9.13 |
-0.29 |
0 |
|
|
20911 |
586298 |
1 |
NOC8H11 |
ABC8D11 |
-40.87 |
4.42 |
-8.95 |
-0.13 |
0 |
|
|
20912 |
586299 |
1 |
NOC8H11 |
ABC8D11 |
-39.58 |
4.86 |
-8.85 |
-0.12 |
0 |
|
|
20913 |
586300 |
1 |
N2O3C7H8 |
A2B3C7D8 |
-84.42 |
3.59 |
-9.24 |
-0.77 |
0 |
|
|
20914 |
586301 |
1 |
OC14H24 |
AB14C24 |
-82.2 |
4.4 |
-9.6 |
0.09 |
0 |
|
|
20915 |
586302 |
1 |
OC10H16 |
AB10C16 |
-46.34 |
2.18 |
-8.62 |
1.44 |
0 |
|
|
20916 |
586303 |
1 |
NOSC15H15 |
ABCD15E15 |
10.34 |
3.73 |
-8.93 |
-1.02 |
0 |
|
|
20917 |
586304 |
1 |
NOSCl2C15H15 |
ABCD2E15F15 |
-15.69 |
2.94 |
-8.71 |
-0.4 |
0 |
|
|
20918 |
586305 |
1 |
OC10H16 |
AB10C16 |
-58.32 |
2.3 |
-8.22 |
1.63 |
0 |
|
|
20919 |
586306 |
1 |
FSO4C10H11 |
ABC4D10E11 |
-192.96 |
4.82 |
-9.16 |
-0.46 |
0 |