List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
307307 |
125299536 |
1 |
ClO2N4C19H19 |
AB2C4D19E19 |
14.2 |
6.67 |
-8.56 |
-1.0 |
0 |
|
|
307308 |
125299540 |
1 |
OS3N4C13H14 |
AB3C4D13E14 |
78.4 |
3.19 |
-8.74 |
-2.8 |
0 |
|
|
307309 |
125299542 |
1 |
SN4O4C23H24 |
AB4C4D23E24 |
-74.68 |
3.25 |
-8.9 |
-1.4 |
0 |
|
|
307310 |
125299543 |
1 |
SN4O4C23H24 |
AB4C4D23E24 |
-70.34 |
4.79 |
-8.92 |
-1.4 |
0 |
|
|
307311 |
125299545 |
1 |
ClO2N3H24C28 |
AB2C3D24E28 |
24.59 |
2.99 |
-9.0 |
-1.09 |
0 |
|
|
307312 |
125299546 |
1 |
O2N3C20H21 |
A2B3C20D21 |
-11.63 |
6.72 |
-8.62 |
-1.22 |
0 |
|
|
307313 |
125299551 |
1 |
NO4H11C13 |
AB4C11D13 |
-98.22 |
2.16 |
-9.69 |
-1.14 |
0 |
|
|
307314 |
125299552 |
1 |
NO4H11C13 |
AB4C11D13 |
-98.39 |
1.47 |
-9.77 |
-1.11 |
0 |
|
|
307315 |
125299559 |
1 |
SCl2N5O5C17H17 |
AB2C5D5E17F17 |
-117.87 |
4.46 |
-9.65 |
-2.06 |
0 |
|
|
307316 |
125299563 |
1 |
ClSO2N3H12C19 |
ABC2D3E12F19 |
36.44 |
4.71 |
-9.3 |
-1.79 |
0 |
|
|
307317 |
125299567 |
1 |
FN3O5C26H32 |
AB3C5D26E32 |
-189.21 |
4.61 |
-8.8 |
-1.08 |
0 |
|
|
307318 |
125299570 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-76.31 |
7.21 |
-8.94 |
-0.97 |
0 |
|
|
307319 |
125299577 |
2 |
NOC10H11 |
ABC10D11 |
-20.88 |
3.25 |
-8.83 |
-0.87 |
0 |
|
|
307321 |
125299581 |
1 |
N3O3H13C16 |
A3B3C13D16 |
-41.58 |
2.97 |
-9.64 |
-1.73 |
0 |
|
|
307323 |
125299585 |
1 |
BrON4H9C10 |
ABC4D9E10 |
61.99 |
1.5 |
-9.33 |
-2.04 |
0 |
|
|
307324 |
125299589 |
1 |
N3O5C26H33 |
A3B5C26D33 |
-150.24 |
6.21 |
-9.0 |
-1.25 |
0 |
|
|
307325 |
125299590 |
1 |
ON5C17H21 |
AB5C17D21 |
57.0 |
3.4 |
-8.81 |
-1.39 |
0 |
|
|
307326 |
125299591 |
1 |
N3O5C26H33 |
A3B5C26D33 |
-147.46 |
5.56 |
-8.84 |
-0.98 |
0 |
|
|
307327 |
125299592 |
1 |
ON2C8H12 |
AB2C8D12 |
-9.24 |
4.48 |
-9.05 |
-0.08 |
0 |
|
|
307328 |
125299595 |
1 |
ClSN3O4C13H14 |
ABC3D4E13F14 |
-78.32 |
6.91 |
-9.71 |
-2.07 |
0 |
|
|
307329 |
125299596 |
1 |
O4N5H17C20 |
A4B5C17D20 |
-24.71 |
4.42 |
-9.0 |
-0.9 |
0 |
|
|
307330 |
125299603 |
1 |
ClO2N6C21H21 |
AB2C6D21E21 |
46.2 |
3.11 |
-9.07 |
-1.39 |
0 |
|
|
307331 |
125299604 |
1 |
BrO3N4H19C22 |
AB3C4D19E22 |
48.8 |
3.93 |
-8.89 |
-0.93 |
0 |
|
|
307332 |
125299605 |
1 |
SN3O4H17C21 |
AB3C4D17E21 |
-26.32 |
4.2 |
-8.99 |
-1.82 |
0 |
|
|
307333 |
125299606 |
1 |
SN3O4H17C21 |
AB3C4D17E21 |
-25.72 |
3.74 |
-8.86 |
-1.77 |
0 |
|
|
307334 |
125299609 |
1 |
BrO3N4H19C22 |
AB3C4D19E22 |
48.26 |
5.12 |
-8.91 |
-0.91 |
0 |
|
|
307335 |
125299610 |
1 |
BrO3N4H19C22 |
AB3C4D19E22 |
48.25 |
3.69 |
-8.86 |
-0.78 |
0 |
|
|
307336 |
125299613 |
1 |
BrNOH2Cl4C6 |
ABCD2E4F6 |
-12.19 |
3.14 |
-9.94 |
-1.44 |
0 |
|
|
307337 |
125299614 |
1 |
ClO3N4C20H25 |
AB3C4D20E25 |
-31.43 |
4.45 |
-8.68 |
-1.65 |
0 |
|
|
307338 |
125299616 |
1 |
ClO3N4C20H25 |
AB3C4D20E25 |
-31.77 |
6.43 |
-8.7 |
-1.6 |
0 |
|
|
307339 |
125299621 |
1 |
ClN2O3H9C15 |
AB2C3D9E15 |
49.71 |
3.76 |
-9.86 |
-2.2 |
0 |
|
|
307340 |
125299625 |
1 |
N3O6H23C24 |
A3B6C23D24 |
-150.7 |
4.39 |
-8.24 |
-0.63 |
0 |
|
|
307341 |
125299627 |
1 |
OSN4C13H16 |
ABC4D13E16 |
56.16 |
3.16 |
-8.78 |
-0.82 |
0 |
|
|
307342 |
125299628 |
1 |
OSN4C13H16 |
ABC4D13E16 |
57.5 |
4.02 |
-8.76 |
-0.8 |
0 |
|
|
307343 |
125299630 |
1 |
N3O4C9H13 |
A3B4C9D13 |
-168.79 |
7.27 |
-10.65 |
-1.1 |
0 |
|
|
307344 |
125299643 |
1 |
ON4C9H10 |
AB4C9D10 |
55.67 |
10.73 |
-9.3 |
-2.04 |
0 |
|
|
307346 |
125299647 |
1 |
OSN4C22H26 |
ABC4D22E26 |
35.56 |
3.37 |
-9.33 |
-1.86 |
0 |
|
|
307347 |
125299648 |
1 |
O2N3H17C19 |
A2B3C17D19 |
-8.5 |
2.6 |
-8.7 |
-1.07 |
0 |
|
|
307348 |
125299651 |
1 |
O8H20C27 |
A8B20C27 |
-207.04 |
2.33 |
-8.52 |
-1.25 |
0 |
|
|
307349 |
125299653 |
1 |
SO3N4H12C13 |
AB3C4D12E13 |
-55.53 |
2.88 |
-8.79 |
-1.15 |
0 |
|
|
307350 |
125299654 |
1 |
SO3N4H12C13 |
AB3C4D12E13 |
-60.95 |
4.04 |
-8.34 |
-1.3 |
0 |
|
|
307351 |
125299657 |
1 |
ClO2S2N4H19C21 |
AB2C2D4E19F21 |
40.46 |
4.79 |
-8.92 |
-0.94 |
0 |
|
|
307352 |
125299666 |
1 |
NO6C20H25 |
AB6C20D25 |
-247.4 |
6.21 |
-9.43 |
-1.03 |
0 |
|
|
307353 |
125299670 |
1 |
N3O5C25H25 |
A3B5C25D25 |
-111.69 |
4.73 |
-9.19 |
-1.28 |
0 |
|
|
307354 |
125299672 |
1 |
O9C46H66 |
A9B46C66 |
-441.85 |
5.86 |
-8.91 |
-0.18 |
0 |
|
|
307355 |
125299675 |
2 |
NOH12C13 |
ABC12D13 |
66.38 |
1.14 |
-8.75 |
-1.18 |
0 |
|
|
307356 |
125299676 |
1 |
N2O5C19H22 |
A2B5C19D22 |
-101.02 |
2.56 |
-8.51 |
-2.1 |
0 |
|
|
307357 |
125299677 |
1 |
OSN5H13C16 |
ABC5D13E16 |
74.08 |
5.35 |
-8.52 |
-0.9 |
0 |
|
|
307358 |
125299678 |
2 |
NOH12C13 |
ABC12D13 |
68.88 |
1.12 |
-8.76 |
-1.18 |
0 |
|
|
307359 |
125299679 |
2 |
NOH12C13 |
ABC12D13 |
67.08 |
1.76 |
-8.91 |
-1.25 |
0 |
|
|
307360 |
125299680 |
1 |
BrFOSN4H18C22 |
ABCDE4F18G22 |
44.55 |
5.01 |
-9.05 |
-1.41 |
0 |
|
|
307361 |
125299682 |
1 |
ClFO2N3H15C19 |
ABC2D3E15F19 |
-16.48 |
1.89 |
-9.78 |
-2.1 |
0 |
|
|
307362 |
125299683 |
1 |
ClFO2N3H15C19 |
ABC2D3E15F19 |
-17.54 |
4.67 |
-9.41 |
-1.82 |
0 |
|
|
307367 |
125299689 |
1 |
ClN3O3H26C29 |
AB3C3D26E29 |
-9.05 |
1.61 |
-8.91 |
-1.17 |
0 |
|
|
307368 |
125299690 |
1 |
BrFOSN4H18C22 |
ABCDE4F18G22 |
43.48 |
4.1 |
-9.02 |
-1.52 |
0 |
|
|
307369 |
125299693 |
1 |
O4C25H36 |
A4B25C36 |
-192.72 |
4.65 |
-9.04 |
-0.41 |
0 |
|
|
307371 |
125299708 |
1 |
O3N4C32H32 |
A3B4C32D32 |
-21.18 |
4.79 |
-9.04 |
-1.14 |
0 |
|
|
307372 |
125299709 |
1 |
N3O5H23C25 |
A3B5C23D25 |
-95.96 |
1.7 |
-8.68 |
-0.63 |
0 |
|
|
307373 |
125299714 |
1 |
N3O5H23C25 |
A3B5C23D25 |
-97.94 |
4.29 |
-8.74 |
-0.72 |
0 |
|
|
307374 |
125299717 |
1 |
SN2O6C30H30 |
AB2C6D30E30 |
-148.42 |
6.03 |
-8.87 |
-0.92 |
0 |
|
|
307375 |
125299728 |
1 |
OSN3C20H33 |
ABC3D20E33 |
1.85 |
6.49 |
-8.84 |
-0.67 |
0 |
|
|
307377 |
125299734 |
1 |
SO2N6H20C21 |
AB2C6D20E21 |
24.99 |
5.15 |
-9.22 |
-1.13 |
0 |
|
|
307378 |
125299736 |
1 |
O5C23H34 |
A5B23C34 |
-195.23 |
1.16 |
-9.66 |
0.08 |
0 |
|
|
307380 |
125299741 |
1 |
ON6H16C24 |
AB6C16D24 |
178.57 |
3.6 |
-8.64 |
-1.52 |
0 |
|
|
307381 |
125299742 |
1 |
N4O11C43H58 |
A4B11C43D58 |
-379.76 |
6.79 |
-7.86 |
-1.14 |
0 |
|
|
307382 |
125299744 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-44.26 |
1.75 |
-9.16 |
-1.4 |
0 |
|
|
307383 |
125299746 |
1 |
BrSO2N4C16H17 |
ABC2D4E16F17 |
-1.38 |
6.33 |
-9.03 |
-1.22 |
0 |
|
|
307384 |
125299749 |
1 |
N2O6C27H30 |
A2B6C27D30 |
-193.31 |
7.27 |
-9.28 |
-1.32 |
0 |
|
|
307385 |
125299753 |
1 |
N2O6C27H30 |
A2B6C27D30 |
-185.2 |
3.77 |
-9.1 |
-1.14 |
0 |
|
|
307386 |
125299754 |
1 |
N2O6C27H30 |
A2B6C27D30 |
-192.76 |
7.78 |
-8.94 |
-0.99 |
0 |
|
|
307387 |
125299755 |
1 |
N2O6C27H30 |
A2B6C27D30 |
-193.41 |
7.04 |
-8.98 |
-1.03 |
0 |
|
|
307388 |
125299759 |
1 |
O5C18H30 |
A5B18C30 |
-245.95 |
6.66 |
-10.3 |
0.31 |
0 |
|
|
307389 |
125299760 |
1 |
O5C18H30 |
A5B18C30 |
-246.3 |
4.96 |
-10.01 |
0.28 |
0 |
|
|
307390 |
125299763 |
1 |
O2S2N7C23H23 |
A2B2C7D23E23 |
92.6 |
4.81 |
-8.24 |
-1.64 |
0 |
|
|
307391 |
125299764 |
1 |
ClFOSN3H19C22 |
ABCDE3F19G22 |
23.3 |
5.07 |
-9.41 |
-2.14 |
0 |