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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
353785 |
127285421 |
1 |
SO2N4C15H24 |
AB2C4D15E24 |
-57.76 |
4.43 |
-8.97 |
0.0 |
0 |
|
|
353786 |
127285422 |
1 |
SO2N4C19H24 |
AB2C4D19E24 |
-24.37 |
4.77 |
-8.33 |
0.03 |
0 |
|
|
353787 |
127285423 |
1 |
SN2O2C15H22 |
AB2C2D15E22 |
-72.63 |
2.41 |
-9.18 |
0.05 |
0 |
|
|
353788 |
127285424 |
1 |
SN2O3C10H20 |
AB2C3D10E20 |
-136.02 |
4.45 |
-9.62 |
0.07 |
0 |
|
|
353789 |
127285425 |
1 |
SN3O3C13H25 |
AB3C3D13E25 |
-157.26 |
4.69 |
-9.7 |
0.18 |
0 |
|
|
353790 |
127285426 |
1 |
SN2O2C15H22 |
AB2C2D15E22 |
-72.36 |
3.01 |
-9.18 |
0.08 |
0 |
|
|
353791 |
127285427 |
1 |
SN2O2C13H24 |
AB2C2D13E24 |
-103.84 |
3.8 |
-9.43 |
0.16 |
0 |
|
|
353792 |
127285428 |
1 |
NSO2C11H21 |
ABC2D11E21 |
-102.95 |
4.07 |
-9.52 |
0.63 |
0 |
|
|
353793 |
127285429 |
1 |
FNSO2C13H16 |
ABCD2E13F16 |
-104.78 |
7.89 |
-9.21 |
-0.66 |
0 |
|
|
353794 |
127285430 |
1 |
NSO3C11H23 |
ABC3D11E23 |
-161.79 |
4.88 |
-9.23 |
0.41 |
0 |
|
|
353795 |
127285431 |
1 |
FNSO3C13H18 |
ABCD3E13F18 |
-167.58 |
6.84 |
-9.1 |
-0.73 |
0 |
|
|
353796 |
127285432 |
1 |
SN2O2C11H22 |
AB2C2D11E22 |
-111.98 |
3.53 |
-9.71 |
0.23 |
0 |
|
|
353797 |
127285433 |
1 |
S2N3O3C13H25 |
A2B3C3D13E25 |
-121.9 |
4.53 |
-8.56 |
-0.11 |
0 |
|
|
353798 |
127285434 |
1 |
SO2N3C16H25 |
AB2C3D16E25 |
-64.48 |
3.07 |
-8.8 |
-0.02 |
0 |
|
|
353799 |
127285435 |
1 |
FSN2O3C14H19 |
ABC2D3E14F19 |
-148.91 |
4.99 |
-9.28 |
-0.28 |
0 |
|
|
353800 |
127285436 |
1 |
NSO3C12H23 |
ABC3D12E23 |
-150.42 |
4.55 |
-9.47 |
0.39 |
0 |
|
|
353801 |
127285437 |
1 |
FNSO3C14H18 |
ABCD3E14F18 |
-157.64 |
6.63 |
-9.09 |
-0.72 |
0 |
|
|
353802 |
127285438 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-111.45 |
3.62 |
-9.72 |
0.14 |
0 |
|
|
353803 |
127285439 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-109.5 |
4.43 |
-9.62 |
0.16 |
0 |
|
|
353804 |
127285440 |
1 |
SN2O2C14H20 |
AB2C2D14E20 |
-65.96 |
3.33 |
-9.16 |
0.04 |
0 |
|
|
353805 |
127285441 |
1 |
SN2O2F3C8H15 |
AB2C2D3E8F15 |
-254.03 |
5.87 |
-9.96 |
-0.26 |
0 |
|
|
353806 |
127285442 |
1 |
SO2N5C10H17 |
AB2C5D10E17 |
-34.8 |
4.35 |
-8.89 |
-0.36 |
0 |
|
|
353807 |
127285443 |
1 |
SN2O2C10H22 |
AB2C2D10E22 |
-109.1 |
5.89 |
-9.68 |
0.21 |
0 |
|
|
353808 |
127285444 |
1 |
SN2O2C10H22 |
AB2C2D10E22 |
-111.49 |
3.65 |
-9.69 |
0.18 |
0 |
|
|
353809 |
127285445 |
1 |
SO2N3C10H21 |
AB2C3D10E21 |
-61.79 |
3.56 |
-8.99 |
0.14 |
0 |
|
|
353810 |
127285446 |
1 |
SN3O3C17H27 |
AB3C3D17E27 |
-105.2 |
2.44 |
-9.0 |
-0.11 |
0 |
|
|
353811 |
127285447 |
1 |
S2N3O4C10H21 |
A2B3C4D10E21 |
-175.8 |
5.0 |
-9.52 |
-0.1 |
0 |
|
|
353812 |
127285448 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-110.59 |
3.74 |
-9.7 |
0.17 |
0 |
|
|
353813 |
127285449 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-109.7 |
4.55 |
-9.32 |
0.03 |
0 |
|
|
353814 |
127285450 |
1 |
SN3O3C15H29 |
AB3C3D15E29 |
-143.51 |
4.56 |
-8.75 |
0.07 |
0 |
|
|
353815 |
127285451 |
1 |
SN3O4C17H25 |
AB3C4D17E25 |
-148.83 |
5.96 |
-9.35 |
-0.16 |
0 |
|
|
353816 |
127285452 |
1 |
SN2O2C11H22 |
AB2C2D11E22 |
-105.07 |
3.33 |
-9.48 |
0.2 |
0 |
|
|
353817 |
127285453 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-141.84 |
3.93 |
-8.69 |
-0.14 |
0 |
|
|
353818 |
127285454 |
1 |
SN2O2C11H20 |
AB2C2D11E20 |
-81.62 |
3.63 |
-9.59 |
0.16 |
0 |
|
|
353819 |
127285459 |
1 |
FNSO3C12H16 |
ABCD3E12F16 |
-153.52 |
7.88 |
-9.32 |
-0.81 |
0 |
|
|
353820 |
127285460 |
1 |
SN2O2C11H22 |
AB2C2D11E22 |
-99.87 |
3.26 |
-9.51 |
0.14 |
0 |
|
|
353821 |
127285461 |
1 |
SO3N4C9H16 |
AB3C4D9E16 |
-68.55 |
3.01 |
-10.05 |
-0.36 |
0 |
|
|
353822 |
127285462 |
1 |
SN2O2C13H26 |
AB2C2D13E26 |
-117.11 |
3.31 |
-9.34 |
0.22 |
0 |
|
|
353823 |
127285463 |
1 |
SN3O3C10H21 |
AB3C3D10E21 |
-122.28 |
4.99 |
-8.82 |
0.11 |
0 |
|
|
353824 |
127285464 |
3 |
NOSC4H7 |
ABCD4E7 |
-116.49 |
2.57 |
-8.81 |
-0.44 |
0 |
|
|
353825 |
127285465 |
1 |
SN3O3C9H17 |
AB3C3D9E17 |
-127.39 |
7.35 |
-9.67 |
-0.07 |
0 |
|
|
353826 |
127285466 |
1 |
SN2O2C12H22 |
AB2C2D12E22 |
-53.41 |
3.22 |
-9.48 |
0.13 |
0 |
|
|
353827 |
127285467 |
1 |
SO3N5C16H25 |
AB3C5D16E25 |
-92.72 |
3.4 |
-8.64 |
-0.05 |
0 |
|
|
353828 |
127285468 |
1 |
S2N3O3C12H21 |
A2B3C3D12E21 |
-122.09 |
4.87 |
-8.83 |
-0.25 |
0 |
|
|
353829 |
127285469 |
1 |
S2N3O3C12H21 |
A2B3C3D12E21 |
-92.67 |
6.31 |
-9.02 |
-0.47 |
0 |
|
|
353830 |
127285470 |
1 |
S2N3O3C12H21 |
A2B3C3D12E21 |
-103.63 |
4.32 |
-9.0 |
-0.56 |
0 |
|
|
353831 |
127285471 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-111.16 |
3.33 |
-9.36 |
0.21 |
0 |
|
|
353832 |
127285472 |
1 |
SO2N3C12H25 |
AB2C3D12E25 |
-99.14 |
3.21 |
-8.64 |
0.07 |
0 |
|
|
353833 |
127285473 |
1 |
S2N4O4C13H26 |
A2B4C4D13E26 |
-147.45 |
4.73 |
-9.76 |
-0.17 |
0 |
|
|
353834 |
127285474 |
1 |
N2O2S2C9H18 |
A2B2C2D9E18 |
-93.79 |
3.71 |
-8.62 |
-0.01 |
0 |
|
|
353835 |
127285475 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-115.39 |
5.8 |
-9.65 |
0.24 |
0 |
|
|
353836 |
127285476 |
1 |
SN2O2C15H22 |
AB2C2D15E22 |
-71.56 |
2.47 |
-9.22 |
0.15 |
0 |
|
|
353837 |
127285477 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-113.8 |
2.9 |
-9.46 |
0.22 |
0 |
|
|
353838 |
127285478 |
1 |
NSO2C10H21 |
ABC2D10E21 |
-119.54 |
3.97 |
-9.62 |
0.62 |
0 |
|
|
353839 |
127285479 |
1 |
SO3N5C15H25 |
AB3C5D15E25 |
-96.38 |
7.51 |
-9.51 |
0.03 |
0 |
|
|
353840 |
127285480 |
1 |
SN3O3C13H25 |
AB3C3D13E25 |
-153.61 |
4.49 |
-9.51 |
-0.26 |
0 |
|
|
353841 |
127285481 |
1 |
S2N4O4C15H20 |
A2B4C4D15E20 |
-76.06 |
7.93 |
-9.29 |
-1.28 |
0 |
|
|
353842 |
127285482 |
1 |
S2N3O3C15H21 |
A2B3C3D15E21 |
-102.71 |
5.66 |
-8.48 |
-0.7 |
0 |
|
|
353843 |
127285483 |
1 |
S2N3O3C16H23 |
A2B3C3D16E23 |
-109.76 |
4.32 |
-8.68 |
-0.52 |
0 |
|
|
353844 |
127285484 |
1 |
S2N3O4C16H25 |
A2B3C4D16E25 |
-146.86 |
5.78 |
-9.51 |
-0.62 |
0 |
|
|
353845 |
127285485 |
1 |
SN2O2C13H26 |
AB2C2D13E26 |
-110.82 |
3.29 |
-9.49 |
0.17 |
0 |
|
|
353846 |
127285486 |
1 |
FSO2N4C17H27 |
ABC2D4E17F27 |
-106.06 |
5.11 |
-8.51 |
-0.24 |
0 |
|
|
353847 |
127285487 |
1 |
S2N3O3C15H27 |
A2B3C3D15E27 |
-143.42 |
5.91 |
-8.79 |
0.16 |
0 |
|
|
353848 |
127285488 |
1 |
FSO3N4C15H21 |
ABC3D4E15F21 |
-150.52 |
5.55 |
-8.97 |
-0.19 |
0 |
|
|
353849 |
127285489 |
1 |
SO2N3C11H23 |
AB2C3D11E23 |
-65.34 |
3.96 |
-8.94 |
0.11 |
0 |
|
|
353850 |
127285490 |
1 |
SN3O3C16H31 |
AB3C3D16E31 |
-150.37 |
2.56 |
-8.85 |
0.2 |
0 |
|
|
353851 |
127285491 |
1 |
SN2O2C10H22 |
AB2C2D10E22 |
-106.37 |
3.5 |
-9.36 |
0.15 |
0 |
|
|
353852 |
127285492 |
1 |
SN2O2C11H22 |
AB2C2D11E22 |
-110.78 |
2.99 |
-9.46 |
0.23 |
0 |
|
|
353853 |
127285493 |
1 |
SO2N5C11H19 |
AB2C5D11E19 |
-47.21 |
4.06 |
-9.46 |
-0.29 |
0 |
|
|
353854 |
127285494 |
1 |
SN2O2C11H24 |
AB2C2D11E24 |
-114.98 |
3.38 |
-9.44 |
0.25 |
0 |
|
|
353855 |
127285495 |
1 |
SN2O2C11H24 |
AB2C2D11E24 |
-105.42 |
4.0 |
-9.41 |
0.15 |
0 |
|
|
353856 |
127285496 |
1 |
SN2O2C10H22 |
AB2C2D10E22 |
-107.84 |
3.75 |
-9.44 |
0.2 |
0 |
|
|
353857 |
127285497 |
1 |
S2N4O4C13H26 |
A2B4C4D13E26 |
-151.08 |
2.32 |
-9.38 |
-0.04 |
0 |
|
|
353858 |
127285498 |
1 |
NSO3C11H23 |
ABC3D11E23 |
-159.27 |
4.09 |
-9.35 |
0.48 |
0 |
|
|
353859 |
127285499 |
1 |
FNSO3C13H18 |
ABCD3E13F18 |
-165.41 |
6.13 |
-9.24 |
-0.71 |
0 |
|
|
353860 |
127285500 |
1 |
SN3O4C14H25 |
AB3C4D14E25 |
-174.46 |
6.31 |
-9.01 |
-0.19 |
0 |
|
|
353861 |
127285501 |
1 |
S2N3O3C13H23 |
A2B3C3D13E23 |
-128.92 |
1.92 |
-8.59 |
-0.32 |
0 |
|
|
353862 |
127285502 |
1 |
SN2O2C10H20 |
AB2C2D10E20 |
-100.06 |
3.45 |
-9.45 |
0.19 |
0 |
|
|
353863 |
127285503 |
1 |
SN2O2C14H26 |
AB2C2D14E26 |
-86.22 |
3.58 |
-9.18 |
0.16 |
0 |
|
|
353864 |
127285504 |
1 |
SO2N3C11H23 |
AB2C3D11E23 |
-69.59 |
3.41 |
-8.92 |
0.16 |
0 |
|
|
353865 |
127285505 |
1 |
ClFSN2O3C16H20 |
ABCD2E3F16G20 |
-165.8 |
7.0 |
-9.25 |
-1.02 |
0 |
|
|
353866 |
127285506 |
1 |
SN2O2C12H22 |
AB2C2D12E22 |
-87.37 |
3.97 |
-9.41 |
0.15 |
0 |
|
|
353867 |
127285507 |
1 |
SN2O2C10H20 |
AB2C2D10E20 |
-105.52 |
3.22 |
-9.39 |
0.27 |
0 |
|
|
353868 |
127285508 |
1 |
SO3N4C13H22 |
AB3C4D13E22 |
-77.85 |
5.05 |
-9.54 |
-0.23 |
0 |
|
|
353869 |
127285509 |
1 |
SN2O2C10H20 |
AB2C2D10E20 |
-74.46 |
3.66 |
-9.45 |
0.08 |
0 |
|
|
353870 |
127285510 |
1 |
NO2S2C10H21 |
AB2C2D10E21 |
-114.01 |
4.39 |
-8.71 |
0.28 |
0 |
|
|
353871 |
127285511 |
1 |
N2O2S2C9H18 |
A2B2C2D9E18 |
-90.4 |
3.86 |
-8.67 |
-0.12 |
0 |
|
|
353872 |
127285512 |
1 |
N2S2O4C13H14 |
A2B2C4D13E14 |
-93.81 |
4.95 |
-9.26 |
-0.79 |
0 |
|
|
353873 |
127285513 |
1 |
S2N3O3C15H17 |
A2B3C3D15E17 |
-75.92 |
3.74 |
-9.45 |
-0.93 |
0 |
|
|
353874 |
127285514 |
1 |
FSN2O3C19H19 |
ABC2D3E19F19 |
-112.85 |
5.2 |
-9.54 |
-0.92 |
0 |
|
|
353875 |
127285515 |
1 |
N2S2O5C17H22 |
A2B2C5D17E22 |
-163.87 |
9.0 |
-9.56 |
-0.87 |
0 |
|
|
353876 |
127285516 |
1 |
FSO2N3C12H18 |
ABC2D3E12F18 |
-91.32 |
3.33 |
-8.98 |
-1.32 |
0 |
|
|
353877 |
127285517 |
1 |
SO2N4C12H22 |
AB2C4D12E22 |
-59.26 |
9.27 |
-8.6 |
0.12 |
0 |
|
|
353878 |
127285518 |
1 |
SN3O3C11H23 |
AB3C3D11E23 |
-124.14 |
3.44 |
-8.94 |
-0.19 |
0 |
|
|
353879 |
127285519 |
1 |
SN3O3C17H25 |
AB3C3D17E25 |
-108.97 |
8.67 |
-8.56 |
-0.62 |
0 |
|
|
353880 |
127285520 |
1 |
N2S2O4C13H26 |
A2B2C4D13E26 |
-185.63 |
7.97 |
-9.05 |
-0.02 |
0 |
|
|
353881 |
127285521 |
1 |
SN3O3C12H25 |
AB3C3D12E25 |
-128.55 |
4.64 |
-8.9 |
-0.13 |
0 |
|
|
353882 |
127285522 |
1 |
SN3O3C18H27 |
AB3C3D18E27 |
-112.16 |
8.62 |
-8.73 |
-0.59 |
0 |
|
|
353883 |
127285523 |
1 |
SN3O3C14H29 |
AB3C3D14E29 |
-142.93 |
5.3 |
-8.99 |
0.09 |
0 |
|
|
353884 |
127285524 |
1 |
N2S3O4C14H24 |
A2B3C4D14E24 |
-167.42 |
7.69 |
-9.47 |
-0.63 |
0 |