List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
388516 |
134989372 |
1 |
NC18H33 |
AB18C33 |
-35.7 |
4.1 |
-9.64 |
1.28 |
0 |
|
|
388517 |
134989373 |
2 |
NO2C6H7 |
AB2C6D7 |
-110.42 |
1.68 |
-9.52 |
-0.94 |
0 |
|
|
388518 |
134989374 |
1 |
O3C12H16 |
A3B12C16 |
-121.79 |
5.72 |
-10.15 |
0.4 |
0 |
|
|
388519 |
134989376 |
1 |
AuN2S4C11H23 |
AB2C4D11E23 |
6.43 |
10.67 |
-7.66 |
-1.92 |
0 |
|
|
388520 |
134989377 |
1 |
NPO4C12H24 |
ABC4D12E24 |
-261.95 |
5.3 |
-9.19 |
0.51 |
0 |
|
|
388521 |
134989378 |
1 |
NSO2C11H15 |
ABC2D11E15 |
-40.56 |
3.43 |
-9.21 |
-0.77 |
0 |
|
|
388522 |
134989379 |
1 |
FSN3C9H12 |
ABC3D9E12 |
2.24 |
6.24 |
-8.5 |
-0.53 |
0 |
|
|
388523 |
134989380 |
1 |
SN4C11H14 |
AB4C11D14 |
87.39 |
3.97 |
-9.07 |
-1.44 |
0 |
|
|
388524 |
134989381 |
1 |
ClN2H11C14 |
AB2C11D14 |
72.47 |
5.79 |
-9.95 |
-1.22 |
0 |
|
|
388525 |
134989382 |
1 |
ClSeO4C8H11 |
ABC4D8E11 |
-0.67 |
13.62 |
-10.08 |
-3.09 |
0 |
|
|
388526 |
134989383 |
1 |
NO4H11C13 |
AB4C11D13 |
-99.25 |
2.11 |
-10.46 |
-2.12 |
0 |
|
|
388527 |
134989384 |
1 |
NC11H17 |
AB11C17 |
17.48 |
2.07 |
-9.17 |
-0.05 |
0 |
|
|
388528 |
134989392 |
1 |
FO2C11H17 |
AB2C11D17 |
-117.11 |
6.69 |
-11.22 |
-0.21 |
0 |
|
|
388529 |
134989399 |
1 |
NSSeC11H11 |
ABCD11E11 |
59.88 |
2.98 |
-8.35 |
-0.49 |
0 |
|
|
388530 |
134989403 |
1 |
NSiC12H15 |
ABC12D15 |
24.62 |
3.88 |
-9.37 |
-0.25 |
0 |
|
|
388531 |
134989407 |
1 |
NO2C13H15 |
AB2C13D15 |
-69.58 |
5.69 |
-9.6 |
0.02 |
0 |
|
|
388532 |
134989410 |
1 |
ClN2O2H9C11 |
AB2C2D9E11 |
24.43 |
7.62 |
-9.8 |
-1.55 |
0 |
|
|
388533 |
134989411 |
1 |
OSeBr2H8C13 |
ABC2D8E13 |
13.09 |
3.09 |
-8.78 |
-2.51 |
0 |
|
|
388534 |
134989412 |
1 |
NO2H11C12 |
AB2C11D12 |
-35.61 |
4.22 |
-9.0 |
-1.14 |
0 |
|
|
388535 |
134989413 |
1 |
NO2H13C15 |
AB2C13D15 |
-6.12 |
2.13 |
-8.44 |
-0.76 |
0 |
|
|
388536 |
134989414 |
1 |
O3H12C13 |
A3B12C13 |
-92.62 |
6.38 |
-8.73 |
-0.64 |
0 |
|
|
388537 |
134989423 |
2 |
O2C5H8 |
A2B5C8 |
-185.42 |
1.89 |
-10.52 |
-0.23 |
0 |
|
|
388538 |
134989427 |
1 |
ClSN2O2C10H11 |
ABC2D2E10F11 |
20.41 |
5.04 |
-9.23 |
-1.8 |
0 |
|
|
388539 |
134989428 |
1 |
NS2O3C10H11 |
AB2C3D10E11 |
-83.07 |
5.08 |
-9.49 |
-0.47 |
0 |
|
|
388540 |
134989433 |
1 |
NO2C13H19 |
AB2C13D19 |
-94.92 |
2.44 |
-9.56 |
0.17 |
0 |
|
|
388541 |
134989437 |
2 |
N2O2H4C5 |
A2B2C4D5 |
-31.08 |
5.34 |
-10.0 |
-1.79 |
0 |
|
|
388542 |
134989438 |
1 |
SN2O3C11H16 |
AB2C3D11E16 |
-130.86 |
4.1 |
-8.88 |
-0.38 |
0 |
|
|
388544 |
134989444 |
1 |
ClO2C12H13 |
AB2C12D13 |
-84.26 |
5.65 |
-9.57 |
-0.34 |
0 |
|
|
388545 |
134989450 |
2 |
NOC7H12 |
ABC7D12 |
-93.44 |
2.71 |
-9.55 |
0.59 |
0 |
|
|
388546 |
134989455 |
1 |
NCl2O3C11H11 |
AB2C3D11E11 |
-114.17 |
1.98 |
-9.38 |
-0.63 |
0 |
|
|
388547 |
134989470 |
1 |
NO3C7H15 |
AB3C7D15 |
-155.53 |
2.23 |
-9.86 |
0.61 |
0 |
|
|
388548 |
134989477 |
1 |
NSiC16H17 |
ABC16D17 |
41.69 |
5.04 |
-8.78 |
-0.41 |
0 |
|
|
388549 |
134989478 |
1 |
ClPN2S2C8H18 |
ABC2D2E8F18 |
25.11 |
4.83 |
-7.83 |
-0.3 |
0 |
|
|
388550 |
134989482 |
2 |
OC5H8 |
AB5C8 |
-99.74 |
4.85 |
-9.48 |
1.11 |
0 |
|
|
388551 |
134989483 |
1 |
KPO2H10C13 |
ABC2D10E13 |
-86.28 |
12.91 |
-7.66 |
-0.08 |
0 |
|
|
388552 |
134989497 |
1 |
NO4C12H17 |
AB4C12D17 |
-134.77 |
2.75 |
-9.17 |
-0.49 |
0 |
|
|
388553 |
134989499 |
1 |
ClSO3N4H5C7 |
ABC3D4E5F7 |
-37.94 |
2.55 |
-10.45 |
-1.76 |
0 |
|
|
388554 |
134989502 |
1 |
O4C13H18 |
A4B13C18 |
-147.76 |
3.9 |
-10.29 |
-0.3 |
0 |
|
|
388555 |
134989504 |
1 |
O3C12H20 |
A3B12C20 |
-163.89 |
4.63 |
-10.02 |
0.83 |
0 |
|
|
388556 |
134989505 |
1 |
NO2C12H23 |
AB2C12D23 |
-107.55 |
3.01 |
-8.71 |
1.12 |
0 |
|
|
388557 |
134989506 |
1 |
NSO3C5H7 |
ABC3D5E7 |
-76.22 |
3.03 |
-9.32 |
-1.08 |
0 |
|
|
388558 |
134989507 |
1 |
NO3C9H17 |
AB3C9D17 |
-137.82 |
3.35 |
-9.74 |
0.44 |
0 |
|
|
388559 |
134989508 |
1 |
PdO4Si4N8C56H72 |
AB4C4D8E56F72 |
282.53 |
18.19 |
-6.46 |
-2.09 |
0 |
|
|
388560 |
134989510 |
2 |
O2N4H37C46 |
A2B4C37D46 |
330.05 |
8.33 |
-7.52 |
-2.17 |
0 |
|
|
388561 |
134989513 |
2 |
N8C40H73 |
A8B40C73 |
-11.27 |
5.02 |
-7.2 |
-1.45 |
0 |
|
|
388562 |
134989518 |
1 |
SO3C10H18 |
AB3C10D18 |
-169.73 |
5.09 |
-9.33 |
-0.52 |
0 |
|
|
388563 |
134989519 |
1 |
ON2C13H18 |
AB2C13D18 |
-13.84 |
3.95 |
-9.32 |
0.32 |
0 |
|
|
388564 |
134989520 |
1 |
ON2C12H24 |
AB2C12D24 |
-67.89 |
3.83 |
-9.28 |
0.9 |
0 |
|
|
388565 |
134989521 |
1 |
NSCl3C5H8 |
ABC3D5E8 |
-10.62 |
2.51 |
-9.51 |
-0.59 |
0 |
|
|
388566 |
134989522 |
1 |
Cl2O2C5H6 |
A2B2C5D6 |
-92.91 |
2.34 |
-10.12 |
-0.97 |
0 |