List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
121462 |
50769024 |
1 |
O3N5H23C26 |
A3B5C23D26 |
-10.85 |
3.63 |
-9.23 |
-1.18 |
0 |
|
|
121463 |
50769025 |
1 |
O3N5C25H27 |
A3B5C25D27 |
-58.71 |
3.69 |
-9.3 |
-1.18 |
0 |
|
|
121464 |
50769093 |
1 |
FSO2N5H20C25 |
ABC2D5E20F25 |
5.04 |
6.72 |
-9.13 |
-1.18 |
0 |
|
|
121465 |
50769094 |
1 |
SO3N5H23C26 |
AB3C5D23E26 |
13.26 |
1.19 |
-8.93 |
-1.36 |
0 |
|
|
121466 |
50769217 |
1 |
SN2O4C19H26 |
AB2C4D19E26 |
-171.87 |
4.44 |
-9.67 |
-0.44 |
0 |
|
|
121467 |
50769325 |
1 |
ON3C18H19 |
AB3C18D19 |
60.52 |
3.33 |
-8.22 |
-0.33 |
0 |
|
|
121468 |
50769326 |
1 |
FON3H14C16 |
ABC3D14E16 |
30.22 |
2.68 |
-8.32 |
-1.13 |
0 |
|
|
121469 |
50769444 |
1 |
O2N3C21H23 |
A2B3C21D23 |
26.19 |
4.12 |
-8.26 |
-0.6 |
0 |
|
|
121470 |
50769506 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-24.78 |
6.08 |
-8.15 |
-0.46 |
0 |
|
|
121471 |
50769507 |
1 |
F2O2N3H15C18 |
A2B2C3D15E18 |
-51.33 |
1.9 |
-8.48 |
-1.34 |
0 |
|
|
121472 |
50769564 |
1 |
SO3N4C25H36 |
AB3C4D25E36 |
-118.91 |
9.64 |
-8.58 |
-0.64 |
0 |
|
|
121473 |
50769568 |
1 |
ClO2N4C22H23 |
AB2C4D22E23 |
2.89 |
3.85 |
-8.52 |
-0.88 |
0 |
|
|
121474 |
50769770 |
1 |
ClO3S3N4H15C17 |
AB3C3D4E15F17 |
-41.46 |
7.7 |
-9.49 |
-1.21 |
0 |
|
|
121475 |
50769860 |
1 |
FOS2N3H20C25 |
ABC2D3E20F25 |
18.07 |
7.25 |
-8.51 |
-1.29 |
0 |
|
|
121476 |
50769861 |
1 |
S2N3O3H23C27 |
A2B3C3D23E27 |
-9.95 |
8.51 |
-8.66 |
-1.42 |
0 |
|
|
121477 |
50769862 |
1 |
OS2N3H23C26 |
AB2C3D23E26 |
51.21 |
6.28 |
-8.53 |
-1.32 |
0 |
|
|
121478 |
50769868 |
1 |
ClO2S2N3H20C26 |
AB2C2D3E20F26 |
15.33 |
8.23 |
-8.58 |
-1.38 |
0 |
|
|
121479 |
50769869 |
1 |
O2S2N3H25C28 |
A2B2C3D25E28 |
7.39 |
7.64 |
-8.59 |
-1.38 |
0 |
|
|
121480 |
50769975 |
1 |
O2S2N3H23C26 |
A2B2C3D23E26 |
14.4 |
5.52 |
-8.51 |
-1.3 |
0 |
|
|
121481 |
50770006 |
1 |
ClS2N3O3H16C24 |
AB2C3D3E16F24 |
0.57 |
5.35 |
-8.69 |
-1.5 |
0 |
|
|
121482 |
50770030 |
1 |
O2S2N3H21C25 |
A2B2C3D21E25 |
22.95 |
5.76 |
-8.51 |
-1.29 |
0 |
|
|
121483 |
50770551 |
1 |
ClO2S2N4H17C22 |
AB2C2D4E17F22 |
53.06 |
3.32 |
-8.86 |
-1.56 |
0 |
|
|
121484 |
50770552 |
1 |
ClOS2N4H17C23 |
ABC2D4E17F23 |
105.02 |
5.41 |
-9.08 |
-1.64 |
0 |
|
|
121485 |
50770553 |
1 |
BrClOS2N4H14C21 |
ABCD2E4F14G21 |
93.2 |
5.39 |
-9.17 |
-1.71 |
0 |
|
|
121486 |
50770554 |
1 |
ClFOS3N4H12C19 |
ABCD3E4F12G19 |
58.21 |
5.79 |
-8.76 |
-1.52 |
0 |
|
|
121487 |
50770555 |
1 |
OS3N4H16C20 |
AB3C4D16E20 |
98.54 |
5.65 |
-8.8 |
-1.54 |
0 |
|
|
121488 |
50770556 |
1 |
ClOS2N4H19C23 |
ABC2D4E19F23 |
78.77 |
4.7 |
-9.13 |
-1.54 |
0 |
|
|
121489 |
50770557 |
1 |
ClOS2N4H19C23 |
ABC2D4E19F23 |
78.19 |
3.97 |
-9.04 |
-1.61 |
0 |
|
|
121490 |
50770558 |
2 |
OSN2H11C12 |
ABC2D11E12 |
49.66 |
4.41 |
-8.76 |
-1.56 |
0 |
|
|
121491 |
50770559 |
2 |
OSN2C13H13 |
ABC2D13E13 |
30.01 |
3.99 |
-8.75 |
-1.53 |
0 |
|
|
121492 |
50770605 |
1 |
OS2N4H22C24 |
AB2C4D22E24 |
77.29 |
4.99 |
-8.9 |
-1.54 |
0 |
|
|
121493 |
50770606 |
1 |
FOS2N4H17C22 |
ABC2D4E17F22 |
49.48 |
3.1 |
-8.81 |
-1.55 |
0 |
|
|
121494 |
50770607 |
1 |
O2S2N4H20C23 |
A2B2C4D20E23 |
53.0 |
5.8 |
-8.73 |
-1.45 |
0 |
|
|
121495 |
50770668 |
1 |
ClOS2N4H19C23 |
ABC2D4E19F23 |
81.12 |
4.68 |
-8.9 |
-1.62 |
0 |
|
|
121496 |
50770920 |
1 |
ClO2S2N4H19C25 |
AB2C2D4E19F25 |
19.88 |
4.67 |
-8.77 |
-1.58 |
0 |
|
|
121497 |
50770921 |
1 |
ClO2S2N4H19C21 |
AB2C2D4E19F21 |
-14.26 |
2.2 |
-8.78 |
-1.59 |
0 |
|
|
121498 |
50770936 |
1 |
ClO2S2N4H21C22 |
AB2C2D4E21F22 |
-24.42 |
6.4 |
-8.74 |
-1.54 |
0 |
|
|
121499 |
50770937 |
1 |
FO2S2N4H19C25 |
AB2C2D4E19F25 |
-16.11 |
3.15 |
-8.86 |
-1.66 |
0 |
|
|
121500 |
50770955 |
1 |
O2S2N4H22C23 |
A2B2C4D22E23 |
-7.11 |
4.93 |
-8.7 |
-1.5 |
0 |
|
|
121501 |
50771028 |
1 |
S2O3N4C24H26 |
A2B3C4D24E26 |
-60.69 |
1.37 |
-8.69 |
-1.48 |
0 |
|
|
121502 |
50771029 |
2 |
SN2O2H11C12 |
AB2C2D11E12 |
-79.31 |
5.01 |
-8.68 |
-1.46 |
0 |
|
|
121503 |
50771129 |
1 |
ON5C24H33 |
AB5C24D33 |
3.52 |
4.79 |
-8.19 |
-0.29 |
0 |
|
|
121504 |
50771185 |
1 |
ClON5C23H30 |
ABC5D23E30 |
0.6 |
2.18 |
-7.98 |
-0.31 |
0 |
|
|
121505 |
50771186 |
1 |
O3N5C24H37 |
A3B5C24D37 |
-113.93 |
5.9 |
-7.79 |
0.0 |
0 |
|
|
121506 |
50771485 |
1 |
ClON7C26H36 |
ABC7D26E36 |
22.61 |
3.98 |
-8.03 |
-0.23 |
0 |
|
|
121507 |
50771785 |
1 |
SO4N5C25H25 |
AB4C5D25E25 |
-59.71 |
6.18 |
-9.07 |
-1.27 |
0 |
|
|
121508 |
50771822 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-46.1 |
4.58 |
-7.89 |
-0.09 |
0 |
|
|
121509 |
50771828 |
1 |
SO3N5H19C20 |
AB3C5D19E20 |
5.15 |
2.87 |
-9.21 |
-1.49 |
0 |
|
|
121510 |
50771829 |
1 |
SO2N5C23H23 |
AB2C5D23E23 |
24.74 |
4.55 |
-9.14 |
-1.32 |
0 |
|
|
121511 |
50771839 |
1 |
ON6C22H36 |
AB6C22D36 |
-17.94 |
1.51 |
-7.83 |
-0.05 |
0 |
|
|
121512 |
50771840 |
1 |
ON5C27H37 |
AB5C27D37 |
2.24 |
4.52 |
-7.82 |
0.0 |
0 |
|
|
121513 |
50771841 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-52.56 |
2.63 |
-8.01 |
-0.1 |
0 |
|
|
121514 |
50771842 |
1 |
S2O3N5H17C19 |
A2B3C5D17E19 |
15.16 |
3.94 |
-9.01 |
-1.28 |
0 |
|
|
121515 |
50771843 |
1 |
FO2S2N5H14C18 |
AB2C2D5E14F18 |
7.65 |
4.12 |
-9.12 |
-1.3 |
0 |
|
|
121516 |
50771861 |
1 |
SO4N5H15C19 |
AB4C5D15E19 |
-19.38 |
6.2 |
-9.25 |
-1.67 |
0 |
|
|
121517 |
50771862 |
1 |
SO2N5H19C21 |
AB2C5D19E21 |
40.28 |
3.87 |
-8.85 |
-1.26 |
0 |
|
|
121518 |
50771863 |
1 |
SO2N5H21C22 |
AB2C5D21E22 |
33.02 |
5.18 |
-8.86 |
-1.07 |
0 |
|
|
121519 |
50771864 |
1 |
FSO2N5H20C22 |
ABC2D5E20F22 |
-16.85 |
4.96 |
-8.93 |
-1.3 |
0 |
|
|
121520 |
50771865 |
1 |
BrSO2N5H20C22 |
ABC2D5E20F22 |
29.22 |
3.48 |
-8.97 |
-1.34 |
0 |
|
|
121521 |
50771935 |
1 |
O2S2N5C16H17 |
A2B2C5D16E17 |
21.42 |
6.37 |
-8.88 |
-1.03 |
0 |
|
|
121522 |
50771950 |
1 |
ON7C27H45 |
AB7C27D45 |
-20.74 |
0.9 |
-7.98 |
-0.17 |
0 |
|
|
121523 |
50771951 |
1 |
O2N5C21H35 |
A2B5C21D35 |
-68.87 |
4.61 |
-7.91 |
-0.09 |
0 |
|
|
121524 |
50771952 |
1 |
O2S2N5C15H17 |
A2B2C5D15E17 |
11.95 |
4.16 |
-9.12 |
-1.28 |
0 |
|
|
121525 |
50771964 |
2 |
ON3C13H18 |
AB3C13D18 |
-21.44 |
6.86 |
-8.11 |
-0.27 |
0 |
|
|
121526 |
50771965 |
1 |
O2N6C25H34 |
A2B6C25D34 |
-11.91 |
3.36 |
-7.86 |
-0.05 |
0 |
|
|
121527 |
50771966 |
1 |
ON5C22H29 |
AB5C22D29 |
10.1 |
3.2 |
-7.94 |
-0.12 |
0 |
|
|
121528 |
50772005 |
1 |
O2S2N5H19C20 |
A2B2C5D19E20 |
39.15 |
4.95 |
-9.03 |
-1.24 |
0 |
|
|
121529 |
50772006 |
1 |
O2S2N5H19C20 |
A2B2C5D19E20 |
44.47 |
4.68 |
-8.99 |
-1.17 |
0 |
|
|
121530 |
50772007 |
1 |
SO4N5H13C16 |
AB4C5D13E16 |
-11.05 |
1.31 |
-9.13 |
-1.37 |
0 |
|
|
121531 |
50772170 |
1 |
SO2N6C24H30 |
AB2C6D24E30 |
27.59 |
6.04 |
-8.35 |
-0.85 |
0 |
|
|
121532 |
50772318 |
1 |
OSN6C25H36 |
ABC6D25E36 |
13.92 |
5.16 |
-8.14 |
-0.8 |
0 |
|
|
121533 |
50772354 |
1 |
FOSN6C25H33 |
ABCD6E25F33 |
-12.18 |
5.4 |
-8.42 |
-0.84 |
0 |
|
|
121534 |
50772355 |
1 |
FOSN7C23H32 |
ABCD7E23F32 |
-4.17 |
5.88 |
-8.12 |
-0.84 |
0 |
|
|
121535 |
50772371 |
1 |
ClNO5C20H20 |
ABC5D20E20 |
-161.9 |
7.25 |
-8.59 |
-0.09 |
0 |
|
|
121536 |
50772520 |
1 |
SO2N6C21H30 |
AB2C6D21E30 |
-5.65 |
2.84 |
-8.46 |
-0.99 |
0 |
|
|
121537 |
50772568 |
1 |
OSF2N6C24H26 |
ABC2D6E24F26 |
-28.62 |
6.23 |
-8.48 |
-0.97 |
0 |
|
|
121538 |
50772569 |
1 |
FSO2N6C26H31 |
ABC2D6E26F31 |
-25.22 |
9.65 |
-7.98 |
-0.55 |
0 |
|
|
121539 |
50772703 |
1 |
N3O3C20H21 |
A3B3C20D21 |
-28.76 |
7.79 |
-8.46 |
-0.73 |
0 |
|
|
121540 |
50772807 |
1 |
O2N3H17C23 |
A2B3C17D23 |
50.38 |
5.8 |
-9.03 |
-0.98 |
0 |
|
|
121541 |
50772808 |
1 |
ON3H17C18 |
AB3C17D18 |
47.97 |
5.85 |
-9.35 |
-0.83 |
0 |
|
|
121542 |
50772862 |
1 |
ON3C19H19 |
AB3C19D19 |
40.52 |
6.41 |
-9.26 |
-0.8 |
0 |
|
|
121543 |
50772960 |
1 |
ClFON3H13C17 |
ABCD3E13F17 |
-7.89 |
5.83 |
-8.8 |
-1.2 |
0 |
|
|
121544 |
50772961 |
1 |
ClFON3H13C17 |
ABCD3E13F17 |
-7.52 |
6.26 |
-8.95 |
-1.15 |
0 |
|
|
121545 |
50772962 |
1 |
FON3C16H18 |
ABC3D16E18 |
-39.43 |
5.09 |
-9.4 |
-1.0 |
0 |
|
|
121546 |
50772963 |
1 |
BrFON3H11C16 |
ABCD3E11F16 |
11.89 |
5.69 |
-8.97 |
-1.31 |
0 |
|
|
121547 |
50773058 |
1 |
SN5O5C26H31 |
AB5C5D26E31 |
-145.24 |
7.98 |
-8.47 |
-1.17 |
0 |
|
|
121548 |
50773165 |
1 |
O3N4H20C22 |
A3B4C20D22 |
-6.85 |
7.29 |
-8.32 |
-0.81 |
0 |
|
|
121549 |
50773166 |
1 |
F3O3N4H21C23 |
A3B3C4D21E23 |
-172.24 |
11.06 |
-8.85 |
-1.05 |
0 |
|
|
121550 |
50773213 |
1 |
N4O5C25H26 |
A4B5C25D26 |
-90.4 |
5.24 |
-8.16 |
-0.57 |
0 |
|
|
121551 |
50773214 |
1 |
F2O3N4H16C21 |
A2B3C4D16E21 |
-90.32 |
3.96 |
-8.6 |
-1.24 |
0 |
|
|
121552 |
50773215 |
1 |
O2F3N5H20C23 |
A2B3C5D20E23 |
-148.09 |
11.29 |
-8.96 |
-0.84 |
0 |
|
|
121553 |
50773216 |
1 |
OF3N4H21C23 |
AB3C4D21E23 |
-115.58 |
9.37 |
-8.97 |
-0.74 |
0 |
|
|
121554 |
50773217 |
1 |
O3N4H22C23 |
A3B4C22D23 |
-16.02 |
4.25 |
-9.14 |
-0.83 |
0 |
|
|
121555 |
50773218 |
1 |
FON4C23H23 |
ABC4D23E23 |
-2.31 |
4.07 |
-8.81 |
-0.84 |
0 |
|
|
121556 |
50773219 |
1 |
FON4C23H23 |
ABC4D23E23 |
-0.48 |
4.41 |
-8.96 |
-0.59 |
0 |
|
|
121557 |
50773220 |
2 |
N2O2C12H13 |
A2B2C12D13 |
-65.04 |
6.5 |
-8.4 |
-0.74 |
0 |
|
|
121558 |
50773221 |
1 |
O3N4C23H24 |
A3B4C23D24 |
-19.7 |
7.4 |
-8.67 |
-0.54 |
0 |
|
|
121559 |
50773222 |
1 |
ClO2N5H20C22 |
AB2C5D20E22 |
0.92 |
5.37 |
-8.79 |
-0.8 |
0 |
|
|
121560 |
50773307 |
1 |
N4O4C27H32 |
A4B4C27D32 |
-76.36 |
3.63 |
-8.19 |
-0.5 |
0 |
|
|
121561 |
50773382 |
1 |
O2N5C26H29 |
A2B5C26D29 |
-12.18 |
8.37 |
-8.71 |
-0.7 |
0 |