List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
195495 |
78694923 |
1 |
SN3O4C19H25 |
AB3C4D19E25 |
-118.14 |
3.84 |
-8.64 |
-0.46 |
-1 |
|
|
195496 |
78694924 |
1 |
BrNO2S2H13C17 |
ABC2D2E13F17 |
47.15 |
2.06 |
0.0 |
0.0 |
0 |
|
|
195497 |
78694925 |
1 |
BrNO2S2H14C17 |
ABC2D2E14F17 |
-5.39 |
5.95 |
-9.44 |
-1.28 |
2 |
|
|
195498 |
78695011 |
1 |
ON3C22H31 |
AB3C22D31 |
14.33 |
12.58 |
-6.98 |
-0.92 |
0 |
|
|
195499 |
78695012 |
1 |
ON3C22H29 |
AB3C22D29 |
-11.24 |
2.02 |
-8.84 |
0.22 |
0 |
|
|
195500 |
78695013 |
1 |
SF2N2O2H16C19 |
AB2C2D2E16F19 |
-111.36 |
3.09 |
-8.99 |
-1.49 |
0 |
|
|
195501 |
78695014 |
1 |
N3O5C16H19 |
A3B5C16D19 |
-187.73 |
4.28 |
-8.72 |
-0.22 |
0 |
|
|
195502 |
78695015 |
1 |
SN3O3H15C18 |
AB3C3D15E18 |
35.91 |
5.54 |
-9.1 |
-1.67 |
1 |
|
|
195503 |
78695016 |
1 |
ON3C20H24 |
AB3C20D24 |
29.99 |
5.11 |
0.0 |
0.0 |
0 |
|
|
195504 |
78695017 |
1 |
ON3C20H23 |
AB3C20D23 |
8.17 |
3.96 |
-8.29 |
0.18 |
1 |
|
|
195505 |
78695018 |
1 |
O2N3C25H28 |
A2B3C25D28 |
-11.14 |
4.26 |
0.0 |
0.0 |
-1 |
|
|
195506 |
78695019 |
1 |
SN2O3H15C19 |
AB2C3D15E19 |
10.22 |
3.72 |
0.0 |
0.0 |
0 |
|
|
195507 |
78695020 |
1 |
SN2O3H16C19 |
AB2C3D16E19 |
-44.57 |
3.72 |
-9.29 |
-1.84 |
0 |
|
|
195508 |
78695021 |
1 |
OSN2H18C19 |
ABC2D18E19 |
27.9 |
3.1 |
-8.99 |
-1.34 |
0 |
|
|
195509 |
78695022 |
1 |
N3O5C15H23 |
A3B5C15D23 |
-229.91 |
4.81 |
-9.84 |
-0.35 |
1 |
|
|
195510 |
78695023 |
1 |
FO2N3C23H23 |
AB2C3D23E23 |
-46.11 |
3.16 |
0.0 |
0.0 |
0 |
|
|
195511 |
78695024 |
1 |
OSN3H15C19 |
ABC3D15E19 |
69.79 |
2.73 |
-9.25 |
-1.64 |
0 |
|
|
195512 |
78695025 |
1 |
ON2S2H18C19 |
AB2C2D18E19 |
35.72 |
3.02 |
-8.69 |
-1.46 |
0 |
|
|
195513 |
78695026 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-75.71 |
3.24 |
-8.41 |
-1.4 |
1 |
|
|
195514 |
78695027 |
1 |
O2N3C27H30 |
A2B3C27D30 |
4.07 |
3.64 |
0.0 |
0.0 |
0 |
|
|
195515 |
78695028 |
1 |
O2N3C27H29 |
A2B3C27D29 |
-4.59 |
2.58 |
-8.38 |
0.08 |
0 |
|
|
195516 |
78695029 |
1 |
N3O6C17H21 |
A3B6C17D21 |
-227.28 |
8.05 |
-8.68 |
-0.52 |
0 |
|
|
195517 |
78695030 |
1 |
ON2S2H16C17 |
AB2C2D16E17 |
31.31 |
4.65 |
-8.74 |
-1.62 |
0 |
|
|
195518 |
78695031 |
1 |
ON2S2H16C17 |
AB2C2D16E17 |
29.85 |
4.1 |
-8.85 |
-1.64 |
0 |
|
|
195519 |
78695032 |
1 |
OSN2C20H20 |
ABC2D20E20 |
16.51 |
4.51 |
-8.8 |
-1.32 |
1 |
|
|
195520 |
78695033 |
1 |
FON2C17H20 |
ABC2D17E20 |
-42.11 |
2.61 |
0.0 |
0.0 |
0 |
|
|
195521 |
78695034 |
1 |
FON2C17H19 |
ABC2D17E19 |
-49.32 |
3.86 |
-9.48 |
-0.1 |
0 |
|
|
195522 |
78695200 |
1 |
SN3O5C19H19 |
AB3C5D19E19 |
-146.14 |
4.53 |
-9.13 |
-0.4 |
0 |
|
|
195523 |
78695201 |
1 |
N3O4H19C22 |
A3B4C19D22 |
-92.2 |
2.91 |
-9.59 |
-0.89 |
0 |
|
|
195524 |
78695276 |
1 |
NF2S2O3H15C16 |
AB2C2D3E15F16 |
-169.79 |
4.39 |
-9.32 |
-2.0 |
0 |
|
|
195525 |
78695383 |
1 |
SN2O3H16C17 |
AB2C3D16E17 |
-17.18 |
5.96 |
-8.71 |
-1.0 |
0 |
|
|
195526 |
78695584 |
1 |
NO3C21H25 |
AB3C21D25 |
-102.87 |
4.54 |
-8.86 |
-0.64 |
0 |
|
|
195527 |
78695585 |
1 |
N3O4C24H25 |
A3B4C24D25 |
-85.78 |
4.21 |
-8.42 |
-0.86 |
2 |
|
|
195528 |
78695586 |
1 |
N3O3C20H33 |
A3B3C20D33 |
-68.75 |
26.21 |
-5.68 |
-1.38 |
0 |
|
|
195529 |
78695687 |
1 |
FNO5C22H22 |
ABC5D22E22 |
-186.36 |
7.16 |
-9.03 |
-1.01 |
0 |
|
|
195530 |
78695688 |
1 |
NO6C24H27 |
AB6C24D27 |
-183.28 |
7.29 |
-9.02 |
-1.07 |
0 |
|
|
195531 |
78695689 |
2 |
NO3C9H11 |
AB3C9D11 |
-208.28 |
5.06 |
-8.94 |
-0.96 |
1 |
|
|
195532 |
78695933 |
1 |
ON2C20H31 |
AB2C20D31 |
-42.09 |
4.14 |
0.0 |
0.0 |
1 |
|
|
195533 |
78696462 |
1 |
SN3O4C20H32 |
AB3C4D20E32 |
-143.36 |
9.67 |
0.0 |
0.0 |
0 |
|
|
195534 |
78696463 |
1 |
SN3O4C20H31 |
AB3C4D20E31 |
-161.36 |
3.76 |
-8.57 |
-0.09 |
0 |
|
|
195535 |
78696469 |
1 |
O2N3C26H31 |
A2B3C26D31 |
-21.13 |
8.06 |
-7.83 |
-0.15 |
1 |
|
|
195536 |
78696628 |
1 |
SN2O3C24H29 |
AB2C3D24E29 |
-49.51 |
9.96 |
0.0 |
0.0 |
-1 |
|
|
195537 |
78697042 |
1 |
SO2N4C21H23 |
AB2C4D21E23 |
16.73 |
4.89 |
0.0 |
0.0 |
-1 |
|
|
195538 |
78697222 |
1 |
SO3N4C18H23 |
AB3C4D18E23 |
-33.92 |
5.66 |
0.0 |
0.0 |
0 |
|
|
195539 |
78697223 |
1 |
SO3N4C18H24 |
AB3C4D18E24 |
-63.62 |
10.6 |
-8.36 |
-0.6 |
-1 |
|
|
195540 |
78697224 |
1 |
SN3O4C16H18 |
AB3C4D16E18 |
-61.2 |
3.9 |
0.0 |
0.0 |
0 |
|
|
195541 |
78697225 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-84.42 |
7.38 |
-8.46 |
-0.79 |
-1 |
|
|
195542 |
78697226 |
1 |
SN3O3C15H16 |
AB3C3D15E16 |
-25.45 |
4.18 |
0.0 |
0.0 |
0 |
|
|
195543 |
78697845 |
1 |
O2S2N3C20H21 |
A2B2C3D20E21 |
-19.96 |
6.63 |
-8.79 |
-1.8 |
1 |
|
|
195544 |
78698041 |
1 |
SO2N4C14H21 |
AB2C4D14E21 |
-64.84 |
2.08 |
0.0 |
0.0 |
0 |