List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
253400 |
103118177 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-31.66 |
4.26 |
-9.31 |
-0.97 |
0 |
|
|
253401 |
103118194 |
1 |
BrFO2N4C13H14 |
ABC2D4E13F14 |
-51.13 |
3.17 |
-9.99 |
-0.82 |
0 |
|
|
253402 |
103118195 |
1 |
ON5H9C13 |
AB5C9D13 |
92.06 |
2.59 |
-8.4 |
-1.23 |
0 |
|
|
253403 |
103118197 |
1 |
ON4H12C15 |
AB4C12D15 |
76.06 |
2.18 |
-8.19 |
-0.69 |
0 |
|
|
253404 |
103118198 |
2 |
ON2C7H9 |
AB2C7D9 |
-11.68 |
3.87 |
-9.48 |
-0.36 |
0 |
|
|
253405 |
103118199 |
1 |
ON4H10C11 |
AB4C10D11 |
58.36 |
2.81 |
-8.26 |
-0.42 |
0 |
|
|
253406 |
103118200 |
1 |
ON4H10C14 |
AB4C10D14 |
77.79 |
4.95 |
-8.21 |
-0.94 |
0 |
|
|
253407 |
103118201 |
1 |
F2O2N4C13H14 |
A2B2C4D13E14 |
-97.25 |
1.83 |
-10.02 |
-0.78 |
0 |
|
|
253408 |
103118202 |
1 |
ON5H9C13 |
AB5C9D13 |
91.58 |
1.51 |
-8.44 |
-1.27 |
0 |
|
|
253409 |
103118276 |
1 |
BrON4H11C14 |
ABC4D11E14 |
60.24 |
1.73 |
-9.54 |
-1.17 |
0 |
|
|
253410 |
103118277 |
1 |
BrON3H14C16 |
ABC3D14E16 |
45.01 |
6.08 |
-8.98 |
-0.58 |
0 |
|
|
253411 |
103118298 |
1 |
ClO2N4C13H15 |
AB2C4D13E15 |
-17.02 |
2.86 |
-9.8 |
-0.55 |
0 |
|
|
253412 |
103118299 |
1 |
BrO2N4C13H15 |
AB2C4D13E15 |
-3.97 |
3.03 |
-9.77 |
-0.68 |
0 |
|
|
253413 |
103118301 |
1 |
BrOSN3H12C14 |
ABCD3E12F14 |
49.89 |
5.45 |
-8.97 |
-0.62 |
0 |
|
|
253414 |
103118305 |
1 |
O3N6C11H18 |
A3B6C11D18 |
-70.25 |
5.46 |
-9.82 |
-0.27 |
0 |
|
|
253415 |
103118307 |
1 |
O4N5C12H19 |
A4B5C12D19 |
-110.31 |
5.13 |
-9.79 |
-0.29 |
0 |
|
|
253416 |
103118309 |
1 |
ION4H11C14 |
ABC4D11E14 |
76.75 |
7.28 |
-8.97 |
-0.9 |
0 |
|
|
253417 |
103118321 |
1 |
SO2N4C12H16 |
AB2C4D12E16 |
-7.89 |
4.29 |
-9.29 |
-0.41 |
0 |
|
|
253418 |
103118328 |
2 |
ON2C7H12 |
AB2C7D12 |
-63.96 |
4.31 |
-9.89 |
-0.28 |
0 |
|
|
253419 |
103118332 |
1 |
O3N4C11H20 |
A3B4C11D20 |
-101.72 |
5.36 |
-9.9 |
-0.25 |
0 |
|
|
253420 |
103118333 |
1 |
O3N4C14H22 |
A3B4C14D22 |
-80.1 |
3.96 |
-9.93 |
-0.46 |
0 |
|
|
253421 |
103118336 |
1 |
O3N5C13H17 |
A3B5C13D17 |
-41.16 |
3.68 |
-9.66 |
-0.65 |
0 |
|
|
253422 |
103118340 |
1 |
BrON5H10C13 |
ABC5D10E13 |
71.71 |
5.17 |
-9.23 |
-1.41 |
0 |
|
|
253423 |
103118344 |
1 |
FION3H11C15 |
ABCD3E11F15 |
15.34 |
6.45 |
-8.91 |
-1.13 |
0 |
|
|
253424 |
103118357 |
1 |
BrON4H13C15 |
ABC4D13E15 |
54.65 |
2.15 |
-9.61 |
-1.29 |
0 |
|
|
253425 |
103118361 |
1 |
BrON3H14C16 |
ABC3D14E16 |
32.63 |
4.5 |
-8.79 |
-0.7 |
0 |
|
|
253426 |
103118364 |
1 |
BrON4H11C14 |
ABC4D11E14 |
51.34 |
1.14 |
-9.01 |
-1.39 |
0 |
|
|
253427 |
103118370 |
1 |
BrFON3H11C15 |
ABCD3E11F15 |
1.72 |
8.42 |
-8.94 |
-0.91 |
0 |
|
|
253428 |
103118371 |
1 |
O3N4C10H18 |
A3B4C10D18 |
-95.67 |
3.14 |
-9.76 |
-0.48 |
0 |
|
|
253429 |
103118373 |
1 |
FO2N4C13H15 |
AB2C4D13E15 |
-52.43 |
2.63 |
-9.57 |
-0.56 |
0 |
|
|
253430 |
103118377 |
1 |
BrON4H11C14 |
ABC4D11E14 |
62.7 |
6.09 |
-9.1 |
-0.86 |
0 |
|
|
253431 |
103118381 |
1 |
O3N5C13H21 |
A3B5C13D21 |
-85.96 |
2.57 |
-9.73 |
-0.33 |
0 |
|
|
253432 |
103118396 |
1 |
ClN6H9C13 |
AB6C9D13 |
114.44 |
2.35 |
-8.38 |
-1.25 |
0 |
|
|
253433 |
103118404 |
1 |
BrN5H10C14 |
AB5C10D14 |
112.66 |
4.42 |
-8.24 |
-0.94 |
0 |
|
|
253434 |
103118409 |
1 |
O2N7C12H19 |
A2B7C12D19 |
5.39 |
3.15 |
-10.0 |
-0.37 |
0 |
|
|
253435 |
103118419 |
1 |
SO2N4C10H18 |
AB2C4D10E18 |
-40.03 |
3.46 |
-8.88 |
-0.34 |
0 |
|
|
253436 |
103118427 |
1 |
FO2N4C14H17 |
AB2C4D14E17 |
-62.48 |
5.44 |
-9.68 |
-0.39 |
0 |
|
|
253437 |
103118429 |
2 |
ON2C7H7 |
AB2C7D7 |
30.2 |
6.25 |
-8.59 |
-0.27 |
0 |
|
|
253438 |
103118433 |
1 |
O2N5C13H15 |
A2B5C13D15 |
25.72 |
2.9 |
-9.5 |
-1.29 |
0 |
|
|
253439 |
103118439 |
1 |
O3N5C13H23 |
A3B5C13D23 |
-102.6 |
2.63 |
-9.72 |
-0.44 |
0 |
|
|
253440 |
103118449 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-89.01 |
2.7 |
-9.75 |
-0.34 |
0 |
|
|
253441 |
103118455 |
1 |
ON3H11C16 |
AB3C11D16 |
88.98 |
5.75 |
-9.61 |
-1.29 |
0 |
|
|
253442 |
103118458 |
2 |
ON2C5H9 |
AB2C5D9 |
-48.59 |
4.2 |
-9.92 |
-0.3 |
0 |
|
|
253443 |
103118459 |
2 |
ON2C5H9 |
AB2C5D9 |
-50.28 |
3.89 |
-9.88 |
-0.28 |
0 |
|
|
253444 |
103118497 |
1 |
ClFO2N4C13H14 |
ABC2D4E13F14 |
-61.92 |
2.53 |
-9.92 |
-0.74 |
0 |
|
|
253445 |
103118506 |
1 |
FON4H9C15 |
ABC4D9E15 |
55.58 |
3.7 |
-9.98 |
-1.67 |
0 |
|
|
253446 |
103118510 |
1 |
ClO2N3H12C14 |
AB2C3D12E14 |
16.93 |
2.2 |
-9.0 |
-0.53 |
0 |
|
|
253447 |
103118521 |
1 |
ON4H8C10 |
AB4C8D10 |
68.69 |
3.28 |
-9.93 |
-1.54 |
0 |
|
|
253448 |
103118545 |
1 |
FON3H10C16 |
ABC3D10E16 |
41.92 |
4.3 |
-9.64 |
-1.3 |
0 |
|
|
253449 |
103118554 |
1 |
SO2N5C10H13 |
AB2C5D10E13 |
9.48 |
5.54 |
-9.96 |
-1.04 |
0 |