List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
309183 |
126539659 |
2 |
O3C14H19 |
A3B14C19 |
-192.76 |
10.86 |
-9.09 |
-0.98 |
0 |
|
|
309184 |
126539664 |
2 |
NC4H9 |
AB4C9 |
-10.49 |
3.09 |
-8.28 |
1.08 |
0 |
|
|
309185 |
126539731 |
1 |
NOC8H15 |
ABC8D15 |
-38.27 |
3.68 |
-8.67 |
0.74 |
0 |
|
|
309186 |
126539738 |
1 |
ON3C17H35 |
AB3C17D35 |
-83.48 |
2.81 |
-8.26 |
2.33 |
0 |
|
|
309187 |
126539747 |
1 |
O2N3C24H33 |
A2B3C24D33 |
-36.89 |
1.92 |
-8.18 |
0.26 |
0 |
|
|
309188 |
126539761 |
1 |
ON3C28H33 |
AB3C28D33 |
56.75 |
2.0 |
-8.07 |
0.1 |
0 |
|
|
309189 |
126539811 |
1 |
NSO2C10H11 |
ABC2D10E11 |
-42.87 |
2.18 |
-8.66 |
-0.87 |
1 |
|
|
309190 |
126539845 |
1 |
SO2N5H36C45 |
AB2C5D36E45 |
223.57 |
5.86 |
0.0 |
0.0 |
0 |
|
|
309191 |
126539853 |
1 |
SN4F5H33C46 |
AB4C5D33E46 |
6.0 |
6.88 |
-8.3 |
-1.2 |
0 |
|
|
309192 |
126539874 |
1 |
ON3C11H17 |
AB3C11D17 |
-14.6 |
3.91 |
-8.78 |
-0.12 |
0 |
|
|
309193 |
126539919 |
1 |
FSO3N5C20H28 |
ABC3D5E20F28 |
-109.04 |
1.26 |
-8.49 |
-0.84 |
0 |
|
|
309194 |
126539938 |
1 |
O6N7C41H63 |
A6B7C41D63 |
-196.91 |
6.57 |
-8.04 |
-0.78 |
0 |
|
|
309195 |
126539942 |
1 |
O6N7C42H65 |
A6B7C42D65 |
-201.51 |
11.98 |
-7.65 |
-1.24 |
0 |
|
|
309196 |
126540003 |
1 |
N3C30H59 |
A3B30C59 |
-88.37 |
3.34 |
-8.32 |
2.84 |
0 |
|
|
309197 |
126540004 |
1 |
NF3C10H18 |
AB3C10D18 |
-192.6 |
4.75 |
-9.27 |
1.69 |
0 |
|
|
309198 |
126540028 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-53.9 |
4.64 |
-9.19 |
-0.46 |
0 |
|
|
309199 |
126540036 |
2 |
O2N3C14H19 |
A2B3C14D19 |
-121.02 |
6.69 |
-9.14 |
-0.41 |
0 |
|
|
309200 |
126540082 |
1 |
FO4N6C25H31 |
AB4C6D25E31 |
-150.38 |
4.91 |
-9.03 |
-0.59 |
0 |
|
|
309201 |
126540088 |
1 |
O3N6C28H36 |
A3B6C28D36 |
-56.45 |
4.03 |
-9.13 |
-0.4 |
0 |
|
|
309202 |
126540138 |
1 |
FS2O4N7C21H22 |
AB2C4D7E21F22 |
-104.2 |
13.47 |
-9.04 |
-1.36 |
1 |
|
|
309203 |
126540188 |
1 |
FO5N6C25H32 |
AB5C6D25E32 |
-206.52 |
2.14 |
0.0 |
0.0 |
0 |
|
|
309204 |
126540211 |
1 |
NO7C18H29 |
AB7C18D29 |
-311.87 |
6.55 |
-9.77 |
0.23 |
0 |
|
|
309206 |
126540289 |
1 |
FON5C20H24 |
ABC5D20E24 |
13.27 |
5.52 |
-8.23 |
-0.72 |
0 |
|
|
309207 |
126540298 |
1 |
ClO2N4C19H23 |
AB2C4D19E23 |
-56.18 |
4.54 |
-9.15 |
-0.54 |
0 |
|
|
309208 |
126540302 |
2 |
O2N3C14H20 |
A2B3C14D20 |
-154.57 |
8.24 |
-9.1 |
-0.4 |
0 |
|
|
309209 |
126540320 |
1 |
SN2O2C17H26 |
AB2C2D17E26 |
-52.08 |
3.46 |
-8.77 |
-0.24 |
0 |
|
|
309210 |
126540339 |
2 |
ON3C11H14 |
AB3C11D14 |
0.81 |
5.48 |
-9.15 |
-0.41 |
0 |
|
|
309211 |
126540363 |
1 |
N4O4C33H48 |
A4B4C33D48 |
-191.09 |
2.35 |
-8.8 |
-0.53 |
0 |
|
|
309212 |
126540376 |
1 |
N4O5C24H42 |
A4B5C24D42 |
-275.93 |
5.71 |
-9.43 |
-0.57 |
0 |
|
|
309213 |
126540408 |
1 |
FN4O8C25H37 |
AB4C8D25E37 |
-387.73 |
3.0 |
-8.76 |
-0.48 |
0 |
|
|
309214 |
126540425 |
1 |
BrFN4O4C20H20 |
ABC4D4E20F20 |
-148.82 |
5.29 |
-8.39 |
-1.26 |
0 |
|
|
309215 |
126540455 |
1 |
N5O6C27H33 |
A5B6C27D33 |
-203.0 |
6.65 |
-8.3 |
-0.47 |
0 |
|
|
309216 |
126540477 |
1 |
FN4O5C29H31 |
AB4C5D29E31 |
-160.47 |
3.9 |
-8.56 |
-0.96 |
0 |
|
|
309217 |
126540491 |
1 |
ON2C29H34 |
AB2C29D34 |
18.94 |
7.86 |
-8.88 |
-0.45 |
0 |
|
|
309218 |
126540507 |
1 |
ClO3N7C26H26 |
AB3C7D26E26 |
-11.39 |
8.1 |
-8.69 |
-1.17 |
0 |
|
|
309219 |
126540509 |
1 |
FSO3N6C17H23 |
ABC3D6E17F23 |
-128.97 |
4.68 |
-8.67 |
-0.4 |
0 |
|
|
309220 |
126540514 |
1 |
NC20H41 |
AB20C41 |
-69.03 |
1.83 |
-8.74 |
2.62 |
0 |
|
|
309221 |
126540562 |
1 |
O3N6C27H34 |
A3B6C27D34 |
-32.79 |
6.19 |
-9.15 |
-0.44 |
0 |
|
|
309223 |
126540665 |
2 |
NO2C7H14 |
AB2C7D14 |
-228.99 |
2.8 |
-9.97 |
0.79 |
0 |
|
|
309224 |
126540682 |
1 |
O3C15H28 |
A3B15C28 |
-174.0 |
3.11 |
-9.69 |
0.16 |
0 |
|
|
309225 |
126540692 |
1 |
SN2O3C29H34 |
AB2C3D29E34 |
-85.67 |
2.65 |
-8.86 |
-0.74 |
0 |
|
|
309227 |
126540764 |
1 |
SO2N6C20H38 |
AB2C6D20E38 |
-99.55 |
5.33 |
-8.84 |
0.36 |
0 |
|
|
309228 |
126540765 |
1 |
SN3O4H21C25 |
AB3C4D21E25 |
-62.17 |
4.92 |
-9.11 |
-1.12 |
0 |
|
|
309229 |
126540775 |
1 |
FN5O5C22H26 |
AB5C5D22E26 |
-172.63 |
5.01 |
-8.75 |
-0.54 |
0 |
|
|
309230 |
126540796 |
1 |
SF2N2O2C19H28 |
AB2C2D2E19F28 |
-194.23 |
2.18 |
-8.85 |
-0.13 |
0 |
|
|
309234 |
126540856 |
1 |
S2N3O3C23H37 |
A2B3C3D23E37 |
-157.65 |
3.82 |
-9.03 |
-1.37 |
0 |
|
|
309235 |
126540868 |
2 |
ON3C15H15 |
AB3C15D15 |
29.67 |
4.96 |
-8.65 |
-0.67 |
0 |
|
|
309236 |
126540869 |
1 |
O2N7H27C28 |
A2B7C27D28 |
66.6 |
9.93 |
-8.6 |
-0.67 |
0 |
|
|
309237 |
126540873 |
1 |
N2O6C13H14 |
A2B6C13D14 |
-211.48 |
1.63 |
-9.08 |
-0.93 |
0 |
|
|
309240 |
126540909 |
2 |
N2C5H7 |
A2B5C7 |
121.94 |
1.42 |
-8.81 |
-0.25 |
0 |