List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
309294 |
126542779 |
1 |
FNH10C13 |
ABC10D13 |
-2.01 |
3.52 |
-9.03 |
-0.62 |
0 |
|
|
309295 |
126542806 |
1 |
NO2H21C29 |
AB2C21D29 |
14.74 |
3.34 |
-9.19 |
-1.12 |
0 |
|
|
309296 |
126542908 |
1 |
BrN2O2C14H23 |
AB2C2D14E23 |
-113.15 |
3.2 |
-9.1 |
-0.24 |
0 |
|
|
309297 |
126542985 |
1 |
SO6N8C46H52 |
AB6C8D46E52 |
-170.32 |
8.42 |
-8.55 |
-0.84 |
0 |
|
|
309298 |
126543220 |
2 |
O3N4C21H25 |
A3B4C21D25 |
-143.4 |
1.74 |
-8.86 |
-0.82 |
0 |
|
|
309299 |
126543361 |
2 |
PN3O3H14C15 |
AB3C3D14E15 |
87.69 |
14.37 |
-7.66 |
-1.7 |
0 |
|
|
309300 |
126543481 |
1 |
N2C9H20 |
A2B9C20 |
-11.88 |
1.97 |
-9.47 |
1.25 |
0 |
|
|
309301 |
126543631 |
2 |
N2C9H16 |
A2B9C16 |
18.88 |
7.3 |
-8.51 |
0.98 |
0 |
|
|
309302 |
126543655 |
1 |
N3H35C48 |
A3B35C48 |
203.94 |
1.04 |
-8.1 |
-0.75 |
0 |
|
|
309303 |
126543752 |
1 |
N3H37C52 |
A3B37C52 |
277.17 |
0.4 |
-8.94 |
-1.06 |
0 |
|
|
309304 |
126543839 |
1 |
SN3H33C44 |
AB3C33D44 |
191.42 |
0.98 |
-8.47 |
-1.06 |
0 |
|
|
309305 |
126543911 |
1 |
N3H37C48 |
A3B37C48 |
205.51 |
1.02 |
-8.42 |
-1.14 |
0 |
|
|
309306 |
126543975 |
1 |
NOC17H29 |
ABC17D29 |
-67.48 |
1.73 |
-8.69 |
0.47 |
0 |
|
|
309307 |
126543977 |
1 |
NC12H23 |
AB12C23 |
-35.61 |
1.62 |
-8.26 |
1.58 |
0 |
|
|
309308 |
126544279 |
1 |
NO3C10H17 |
AB3C10D17 |
-158.95 |
3.0 |
-9.76 |
0.29 |
0 |
|
|
309309 |
126544304 |
1 |
O2F3N3H16C23 |
A2B3C3D16E23 |
-94.59 |
4.07 |
-9.24 |
-1.6 |
0 |
|
|
309310 |
126544306 |
1 |
FN4O4C23H27 |
AB4C4D23E27 |
-157.9 |
2.55 |
-9.84 |
-0.92 |
0 |
|
|
309311 |
126544329 |
1 |
SF3N4O4H19C21 |
AB3C4D4E19F21 |
-186.56 |
4.04 |
-9.32 |
-1.74 |
0 |
|
|
309312 |
126544414 |
1 |
ON3C21H21 |
AB3C21D21 |
37.92 |
4.0 |
-9.19 |
-0.64 |
0 |
|
|
309313 |
126544415 |
1 |
O3F4N4H18C22 |
A3B4C4D18E22 |
-195.15 |
2.18 |
-9.89 |
-1.92 |
0 |
|
|
309314 |
126544466 |
1 |
F3O3N4C25H25 |
A3B3C4D25E25 |
-181.33 |
3.14 |
-9.23 |
-1.81 |
0 |
|
|
309315 |
126544473 |
1 |
F3O3N4H17C22 |
A3B3C4D17E22 |
-150.31 |
3.32 |
-9.28 |
-1.1 |
0 |
|
|
309316 |
126544495 |
1 |
N4C7H16 |
A4B7C16 |
29.44 |
3.47 |
-8.95 |
0.54 |
0 |
|
|
309317 |
126544557 |
1 |
N3C23H29 |
A3B23C29 |
70.38 |
3.09 |
-8.33 |
-0.28 |
0 |
|
|
309318 |
126544559 |
1 |
FC27H35 |
AB27C35 |
-62.37 |
1.47 |
-8.85 |
0.06 |
0 |
|
|
309319 |
126544602 |
1 |
PN3O9C21H24 |
AB3C9D21E24 |
-372.91 |
10.35 |
-9.59 |
-0.44 |
0 |
|
|
309320 |
126544723 |
2 |
OF2N4C13H14 |
AB2C4D13E14 |
-105.51 |
10.19 |
-8.25 |
-0.9 |
0 |
|
|
309321 |
126544756 |
1 |
NS2O4C14H17 |
AB2C4D14E17 |
-114.94 |
5.8 |
-8.42 |
-1.19 |
0 |
|
|
309322 |
126544813 |
2 |
O2N6C11H26 |
A2B6C11D26 |
-96.38 |
4.85 |
-8.96 |
-0.43 |
0 |
|
|
309323 |
126544827 |
1 |
N4O4C27H30 |
A4B4C27D30 |
-113.2 |
3.87 |
-9.11 |
-1.01 |
0 |
|
|
309324 |
126544966 |
1 |
ON3C9H9 |
AB3C9D9 |
17.48 |
0.15 |
-9.44 |
-0.72 |
0 |
|
|
309325 |
126544987 |
1 |
O2N3C24H25 |
A2B3C24D25 |
-4.72 |
3.55 |
-8.78 |
-0.86 |
0 |
|
|
309326 |
126545076 |
1 |
SO4N5C26H27 |
AB4C5D26E27 |
-90.59 |
4.73 |
-9.14 |
-1.21 |
0 |
|
|
309327 |
126545108 |
1 |
SO4N7H25C27 |
AB4C7D25E27 |
-37.0 |
4.63 |
-9.05 |
-1.63 |
0 |
|
|
309328 |
126545112 |
1 |
FO3N5H20C26 |
AB3C5D20E26 |
-27.99 |
2.21 |
-9.31 |
-1.46 |
0 |
|
|
309329 |
126545198 |
1 |
O2N5H25C31 |
A2B5C25D31 |
87.08 |
3.65 |
-8.91 |
-1.04 |
0 |
|
|
309330 |
126545224 |
1 |
BrN3O3C18H22 |
AB3C3D18E22 |
-114.2 |
6.07 |
-9.3 |
-1.12 |
0 |
|
|
309331 |
126545242 |
1 |
N5C50H79 |
A5B50C79 |
-24.95 |
7.43 |
-7.98 |
0.44 |
0 |
|
|
309332 |
126545254 |
1 |
ON3C7H13 |
AB3C7D13 |
38.49 |
7.62 |
-8.34 |
-0.94 |
0 |
|
|
309333 |
126545266 |
1 |
N2O5C38H44 |
A2B5C38D44 |
-136.03 |
7.31 |
-8.34 |
0.01 |
0 |
|
|
309334 |
126545308 |
1 |
F2O4C19H22 |
A2B4C19D22 |
-231.98 |
4.81 |
-9.08 |
-0.4 |
0 |
|
|
309335 |
126545310 |
1 |
F2O4C19H22 |
A2B4C19D22 |
-231.52 |
4.34 |
-9.12 |
-0.45 |
0 |
|
|
309336 |
126545338 |
1 |
F2O3C17H18 |
A2B3C17D18 |
-197.86 |
4.92 |
-9.6 |
-0.49 |
0 |
|
|
309337 |
126545375 |
1 |
FN4O5C22H23 |
AB4C5D22E23 |
-131.44 |
4.94 |
-9.64 |
-0.93 |
0 |
|
|
309338 |
126545404 |
1 |
O4C21H26 |
A4B21C26 |
-130.24 |
5.41 |
-8.75 |
-0.43 |
0 |
|
|
309339 |
126545412 |
1 |
F3O5C21H21 |
A3B5C21D21 |
-308.63 |
4.02 |
-9.44 |
-0.73 |
0 |
|
|
309340 |
126545457 |
1 |
O2N7C21H35 |
A2B7C21D35 |
-94.35 |
3.08 |
-9.12 |
0.16 |
0 |
|
|
309341 |
126545494 |
1 |
O5C24H30 |
A5B24C30 |
-175.04 |
5.11 |
-8.63 |
-0.19 |
0 |
|
|
309342 |
126545519 |
1 |
F2O3C21H24 |
A2B3C21D24 |
-178.38 |
3.25 |
-9.05 |
-0.37 |
0 |
|
|
309343 |
126545543 |
2 |
NOC9H15 |
ABC9D15 |
-116.06 |
7.01 |
-9.1 |
0.06 |
1 |