List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
431443 |
135171523 |
1 |
SBr2O2N4C11H12 |
AB2C2D4E11F12 |
-13.63 |
6.44 |
-9.18 |
-1.17 |
0 |
|
|
431444 |
135171524 |
1 |
BrClOSN4C14H18 |
ABCDE4F14G18 |
8.81 |
4.13 |
-8.29 |
-0.5 |
0 |
|
|
431445 |
135171525 |
1 |
NI2O2H13C20 |
AB2C2D13E20 |
33.09 |
0.29 |
-8.42 |
-1.01 |
0 |
|
|
431446 |
135171526 |
1 |
OC20H22 |
AB20C22 |
-11.32 |
3.75 |
-8.86 |
-1.18 |
0 |
|
|
431447 |
135171527 |
1 |
OC19H20 |
AB19C20 |
-2.27 |
3.86 |
-8.9 |
-1.25 |
0 |
|
|
431448 |
135171528 |
1 |
O2N3H27C49 |
A2B3C27D49 |
260.63 |
3.44 |
-8.18 |
-1.89 |
0 |
|
|
431449 |
135171529 |
2 |
NOH14C24 |
ABC14D24 |
167.88 |
1.56 |
-8.04 |
-1.14 |
0 |
|
|
431450 |
135171530 |
2 |
NOH15C26 |
ABC15D26 |
244.25 |
3.23 |
-8.13 |
-1.55 |
0 |
|
|
431451 |
135171531 |
2 |
NSH15C26 |
ABC15D26 |
237.92 |
2.25 |
-8.04 |
-1.27 |
0 |
|
|
431452 |
135171532 |
2 |
NOH14C24 |
ABC14D24 |
161.92 |
0.64 |
-8.06 |
-1.15 |
0 |
|
|
431453 |
135171533 |
2 |
NOH14C24 |
ABC14D24 |
162.35 |
2.26 |
-7.96 |
-0.89 |
0 |
|
|
431454 |
135171534 |
1 |
SN5O5H65C119 |
AB5C5D65E119 |
416.3 |
3.04 |
-8.21 |
-1.28 |
0 |
|
|
431455 |
135171535 |
2 |
NOH16C27 |
ABC16D27 |
184.68 |
1.85 |
-8.05 |
-1.16 |
0 |
|
|
431456 |
135171536 |
2 |
NSH19C33 |
ABC19D33 |
288.13 |
1.87 |
-7.96 |
-0.93 |
0 |
|
|
431457 |
135171537 |
2 |
NOH20C33 |
ABC20D33 |
237.4 |
2.35 |
-7.9 |
-1.04 |
0 |
|
|
431458 |
135171538 |
1 |
FH21C29 |
AB21C29 |
96.0 |
2.31 |
-8.82 |
-0.48 |
0 |
|
|
431459 |
135171540 |
2 |
N2H31C39 |
A2B31C39 |
270.47 |
2.29 |
-7.5 |
-0.34 |
0 |
|
|
431460 |
135171541 |
1 |
FSO2N5C18H20 |
ABC2D5E18F20 |
-20.48 |
5.62 |
-8.5 |
-0.59 |
0 |
|
|
431461 |
135171542 |
1 |
OH12C15 |
AB12C15 |
5.49 |
4.07 |
-8.93 |
-1.36 |
0 |
|
|
431462 |
135171543 |
1 |
NOSC17H33 |
ABCD17E33 |
-107.66 |
4.99 |
-8.91 |
0.16 |
0 |
|
|
431463 |
135171544 |
1 |
ClO2H9C18 |
AB2C9D18 |
11.63 |
2.16 |
-8.96 |
-1.28 |
0 |
|
|
431464 |
135171545 |
1 |
ClSO2N5C16H16 |
ABC2D5E16F16 |
25.24 |
4.72 |
-8.47 |
-0.89 |
0 |
|
|
431465 |
135171546 |
1 |
ClSO2N4H15C17 |
ABC2D4E15F17 |
32.99 |
3.71 |
-8.63 |
-0.96 |
0 |
|
|
431466 |
135171547 |
1 |
ClNO2H8C10 |
ABC2D8E10 |
-47.9 |
1.23 |
-9.79 |
-1.23 |
0 |
|
|
431467 |
135171548 |
1 |
ON3C10H11 |
AB3C10D11 |
-12.35 |
6.03 |
-9.31 |
-0.74 |
0 |
|
|
431468 |
135171549 |
1 |
ON3C9H9 |
AB3C9D9 |
3.59 |
3.95 |
-9.55 |
-1.07 |
0 |
|
|
431469 |
135171550 |
2 |
ON2C9H12 |
AB2C9D12 |
-25.66 |
6.17 |
-8.9 |
-0.85 |
0 |
|
|
431470 |
135171551 |
1 |
FSO2N5C17H18 |
ABC2D5E17F18 |
-17.49 |
6.02 |
-8.56 |
-0.6 |
0 |
|
|
431471 |
135171552 |
1 |
O2N5H19C20 |
A2B5C19D20 |
23.47 |
7.39 |
-9.12 |
-0.88 |
0 |
|
|
431472 |
135171553 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-50.5 |
6.54 |
-8.8 |
-0.68 |
0 |
|
|
431473 |
135171554 |
1 |
ClSN3O3C18H18 |
ABC3D3E18F18 |
-59.64 |
2.52 |
-8.51 |
-0.72 |
0 |
|
|
431474 |
135171555 |
1 |
ClFO2H12C19 |
ABC2D12E19 |
-48.2 |
3.84 |
-8.81 |
-0.73 |
0 |
|
|
431475 |
135171556 |
1 |
FO2H11C18 |
AB2C11D18 |
-43.39 |
0.75 |
-8.7 |
-0.72 |
0 |
|
|
431476 |
135171557 |
1 |
FO2H13C19 |
AB2C13D19 |
-38.62 |
1.98 |
-8.78 |
-0.61 |
0 |
|
|
431477 |
135171558 |
1 |
BrFOH6C12 |
ABCD6E12 |
-19.22 |
3.39 |
-9.28 |
-0.98 |
0 |
|
|
431478 |
135171559 |
1 |
OF2H12C14 |
AB2C12D14 |
-94.29 |
2.03 |
-8.91 |
-0.43 |
0 |
|
|
431479 |
135171560 |
1 |
IOF2H9C13 |
ABC2D9E13 |
-67.6 |
3.38 |
-9.03 |
-1.1 |
0 |
|
|
431480 |
135171561 |
1 |
ClSO2N4C18H19 |
ABC2D4E18F19 |
13.73 |
4.83 |
-8.36 |
-0.57 |
0 |
|
|
431481 |
135171562 |
2 |
NOH14C24 |
ABC14D24 |
160.84 |
1.95 |
-8.05 |
-0.98 |
0 |
|
|
431482 |
135171563 |
2 |
NOH14C24 |
ABC14D24 |
167.93 |
2.09 |
-7.92 |
-0.99 |
0 |
|
|
431483 |
135171564 |
2 |
NOH14C24 |
ABC14D24 |
166.55 |
1.23 |
-7.95 |
-1.04 |
0 |
|
|
431484 |
135171565 |
2 |
NOH14C24 |
ABC14D24 |
162.39 |
2.27 |
-7.98 |
-1.0 |
0 |
|
|
431485 |
135171566 |
2 |
NOH14C24 |
ABC14D24 |
167.61 |
1.34 |
-7.98 |
-1.16 |
0 |
|
|
431486 |
135171567 |
1 |
FSO2N4C20H23 |
ABC2D4E20F23 |
-35.71 |
2.54 |
-8.3 |
-0.42 |
0 |
|
|
431487 |
135171568 |
1 |
ClSO2N5C19H20 |
ABC2D5E19F20 |
23.76 |
3.87 |
-8.45 |
-0.8 |
0 |
|
|
431488 |
135171569 |
1 |
BrF2O2H15C20 |
AB2C2D15E20 |
-100.61 |
4.51 |
-8.65 |
-0.29 |
0 |
|
|
431489 |
135171570 |
1 |
FSO2N5C18H20 |
ABC2D5E18F20 |
-25.37 |
4.29 |
-8.46 |
-0.66 |
0 |
|
|
431490 |
135171571 |
1 |
PN6O6C23H39 |
AB6C6D23E39 |
-276.68 |
3.93 |
-8.74 |
-0.32 |
0 |
|
|
431491 |
135171572 |
2 |
NOH14C24 |
ABC14D24 |
163.04 |
2.01 |
-8.14 |
-1.25 |
0 |
|
|
431492 |
135171573 |
1 |
FSO2N5C19H22 |
ABC2D5E19F22 |
-26.21 |
5.61 |
-8.37 |
-0.53 |
0 |
|
|
431493 |
135171574 |
1 |
IOF2H9C13 |
ABC2D9E13 |
-64.83 |
4.58 |
-9.03 |
-1.08 |
0 |
|
|
431494 |
135171575 |
1 |
BrIOF2H8C13 |
ABCD2E8F13 |
-62.34 |
4.9 |
-9.16 |
-1.2 |
0 |
|
|
431495 |
135171576 |
1 |
BrOF2H11C14 |
ABC2D11E14 |
-89.96 |
4.36 |
-8.99 |
-0.39 |
0 |
|
|
431496 |
135171577 |
1 |
ClSO2N5C17H18 |
ABC2D5E17F18 |
16.92 |
4.6 |
-8.5 |
-0.73 |
0 |
|
|
431497 |
135171578 |
1 |
NC7H11 |
AB7C11 |
15.24 |
3.46 |
-9.13 |
0.35 |
0 |
|
|
431498 |
135171579 |
1 |
NC7H7 |
AB7C7 |
106.98 |
3.58 |
-10.28 |
0.26 |
0 |
|
|
431499 |
135171580 |
1 |
ClF2O2H15C20 |
AB2C2D15E20 |
-109.6 |
4.49 |
-8.86 |
-0.39 |
0 |
|
|
431500 |
135171581 |
1 |
ClSF3N3O3C19H19 |
ABC3D3E3F19G19 |
-234.82 |
4.07 |
-8.89 |
-1.01 |
0 |
|
|
431501 |
135171582 |
1 |
ClSO2N4H15C17 |
ABC2D4E15F17 |
33.35 |
3.41 |
-8.62 |
-0.84 |
0 |
|
|
431502 |
135171583 |
1 |
ClSO2N5C18H20 |
ABC2D5E18F20 |
16.23 |
2.45 |
-8.44 |
-0.69 |
0 |
|
|
431503 |
135171584 |
1 |
ClSO2N5C17H18 |
ABC2D5E17F18 |
26.16 |
7.4 |
-8.76 |
-1.08 |
0 |
|
|
431504 |
135171585 |
1 |
FSN3O3C19H22 |
ABC3D3E19F22 |
-109.82 |
3.26 |
-8.55 |
-0.61 |
0 |
|
|
431505 |
135171586 |
1 |
SN3C34H59 |
AB3C34D59 |
-47.02 |
7.62 |
-7.96 |
1.05 |
0 |
|
|
431506 |
135171587 |
1 |
NC13H27 |
AB13C27 |
-46.39 |
2.68 |
-9.47 |
1.38 |
0 |
|
|
431507 |
135171588 |
1 |
N2O2C11H20 |
A2B2C11D20 |
-88.67 |
2.95 |
-9.02 |
0.86 |
0 |
|
|
431508 |
135171589 |
1 |
NH29C50 |
AB29C50 |
302.45 |
2.43 |
-7.96 |
-1.12 |
0 |
|
|
431509 |
135171590 |
2 |
N3H28C50 |
A3B28C50 |
524.02 |
1.59 |
-8.08 |
-1.29 |
0 |
|
|
431510 |
135171591 |
1 |
N7H83C150 |
A7B83C150 |
771.28 |
3.72 |
-8.02 |
-1.2 |
0 |
|
|
431511 |
135171592 |
1 |
N3H55C97 |
A3B55C97 |
588.98 |
2.94 |
-8.05 |
-1.05 |
0 |
|
|
431512 |
135171593 |
1 |
ClFO2H10C18 |
ABC2D10E18 |
-54.16 |
4.5 |
-8.98 |
-1.04 |
0 |
|
|
431513 |
135171594 |
1 |
ClO2H9C18 |
AB2C9D18 |
11.87 |
2.59 |
-8.94 |
-1.04 |
0 |
|
|
431514 |
135171595 |
1 |
PF2N6O7C32H33 |
AB2C6D7E32F33 |
-319.84 |
6.85 |
-8.93 |
-0.97 |
0 |
|
|
431515 |
135171596 |
1 |
OSN2H30C52 |
ABC2D30E52 |
207.15 |
1.79 |
-8.04 |
-0.98 |
0 |
|
|
431516 |
135171597 |
1 |
N2O2H36C57 |
A2B2C36D57 |
176.89 |
2.27 |
-8.11 |
-1.24 |
0 |
|
|
431517 |
135171598 |
2 |
NOH16C27 |
ABC16D27 |
185.5 |
2.17 |
-7.97 |
-1.16 |
0 |