List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
289650 |
104363521 |
1 |
ClNO2C17H20 |
ABC2D17E20 |
-49.01 |
3.41 |
-8.54 |
0.07 |
0 |
|
|
289651 |
104363538 |
1 |
BrClNOC17H17 |
ABCDE17F17 |
-10.66 |
3.74 |
-8.5 |
-0.16 |
0 |
|
|
289652 |
104363676 |
1 |
BrNOSC16H24 |
ABCDE16F24 |
-42.87 |
3.39 |
-8.48 |
0.09 |
0 |
|
|
289653 |
104363682 |
1 |
BrNOSC17H24 |
ABCDE17F24 |
-38.85 |
4.03 |
-8.48 |
-0.22 |
0 |
|
|
289654 |
104363691 |
1 |
ClON3C15H18 |
ABC3D15E18 |
12.41 |
1.99 |
-8.51 |
0.1 |
0 |
|
|
289655 |
104363772 |
1 |
ClNOC15H20 |
ABCD15E20 |
-46.09 |
1.84 |
-8.49 |
0.03 |
0 |
|
|
289656 |
104363773 |
1 |
BrNOC16H22 |
ABCD16E22 |
-42.94 |
3.32 |
-8.57 |
0.17 |
0 |
|
|
289657 |
104363781 |
1 |
BrNOC17H24 |
ABCD17E24 |
-47.46 |
3.26 |
-8.55 |
0.19 |
0 |
|
|
289658 |
104363947 |
1 |
BrON4C14H17 |
ABC4D14E17 |
34.55 |
2.96 |
-8.8 |
-0.17 |
0 |
|
|
289659 |
104364146 |
1 |
BrSN2O2H13C14 |
ABC2D2E13F14 |
-9.48 |
4.43 |
-8.54 |
-0.47 |
0 |
|
|
289660 |
104364228 |
1 |
OBr2C14H18 |
AB2C14D18 |
-47.52 |
4.99 |
-8.85 |
-0.16 |
0 |
|
|
289661 |
104364232 |
1 |
OBr2C13H16 |
AB2C13D16 |
-42.93 |
4.96 |
-8.82 |
-0.15 |
0 |
|
|
289662 |
104364327 |
1 |
BrNO2C14H18 |
ABC2D14E18 |
-57.91 |
3.05 |
-8.71 |
-0.04 |
0 |
|
|
289663 |
104364518 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-79.0 |
2.75 |
-8.71 |
-0.12 |
0 |
|
|
289664 |
104364530 |
1 |
BrNOC17H26 |
ABCD17E26 |
-53.04 |
1.21 |
-8.7 |
-0.07 |
0 |
|
|
289665 |
104364624 |
1 |
ClNOC18H26 |
ABCD18E26 |
-53.2 |
1.82 |
-8.63 |
-0.05 |
0 |
|
|
289666 |
104364798 |
1 |
BrClNOC16H21 |
ABCDE16F21 |
-46.43 |
5.75 |
-8.81 |
-0.16 |
0 |
|
|
289667 |
104364962 |
1 |
BClKOF3H8C9 |
ABCDE3F8G9 |
-327.94 |
19.28 |
-8.09 |
-0.75 |
0 |
|
|
289668 |
104365110 |
1 |
BrON3C16H20 |
ABC3D16E20 |
11.35 |
6.22 |
-8.7 |
-0.45 |
0 |
|
|
289669 |
104365124 |
1 |
BrON3C15H18 |
ABC3D15E18 |
18.68 |
4.49 |
-9.0 |
-0.44 |
0 |
|
|
289670 |
104365146 |
1 |
BrON3C16H20 |
ABC3D16E20 |
2.12 |
4.04 |
-8.63 |
-0.39 |
0 |
|
|
289671 |
104365158 |
1 |
ClO2C14H15 |
AB2C14D15 |
-83.49 |
5.02 |
-8.83 |
-0.25 |
0 |
|
|
289672 |
104365315 |
1 |
BrO2C15H21 |
AB2C15D21 |
-97.08 |
2.77 |
-8.74 |
-0.07 |
0 |
|
|
289673 |
104365391 |
1 |
ClFSO2H12C15 |
ABCD2E12F15 |
-74.74 |
6.06 |
-8.54 |
-0.48 |
0 |
|
|
289674 |
104365556 |
1 |
ClN2O3C15H17 |
AB2C3D15E17 |
-120.46 |
4.17 |
-9.0 |
-0.44 |
0 |
|
|
289675 |
104365571 |
1 |
BrNOC14H20 |
ABCD14E20 |
-43.57 |
3.97 |
-8.73 |
-0.08 |
0 |
|
|
289676 |
104365874 |
1 |
BrClOC18H18 |
ABCD18E18 |
-22.94 |
4.75 |
-8.8 |
-0.12 |
0 |
|
|
289677 |
104366045 |
1 |
ClNOC12H12 |
ABCD12E12 |
7.09 |
3.12 |
-8.64 |
-0.4 |
0 |
|
|
289678 |
104366261 |
1 |
ClSO2C13H13 |
ABC2D13E13 |
-72.03 |
3.78 |
-8.8 |
-0.58 |
0 |
|
|
289679 |
104366522 |
1 |
OSN2C13H14 |
ABC2D13E14 |
32.45 |
1.95 |
-8.54 |
-1.05 |
0 |
|
|
289680 |
104366553 |
1 |
NSO2C12H17 |
ABC2D12E17 |
-57.02 |
2.7 |
-8.32 |
-1.01 |
0 |
|
|
289681 |
104366752 |
1 |
NOSC14H21 |
ABCD14E21 |
-25.67 |
4.54 |
-8.19 |
-0.86 |
0 |
|
|
289682 |
104366773 |
1 |
SN2O2C12H18 |
AB2C2D12E18 |
-48.3 |
4.72 |
-8.39 |
-1.02 |
0 |
|
|
289683 |
104366866 |
1 |
BrOSN2H5C8 |
ABCD2E5F8 |
55.51 |
2.35 |
-9.45 |
-1.72 |
0 |
|
|
289684 |
104366884 |
1 |
OSN2C10H10 |
ABC2D10E10 |
22.84 |
2.54 |
-9.14 |
-1.48 |
0 |
|
|
289685 |
104366898 |
1 |
ClOSN2H7C9 |
ABCD2E7F9 |
36.5 |
3.5 |
-8.94 |
-1.49 |
0 |
|
|
289686 |
104367095 |
1 |
SO3C14H14 |
AB3C14D14 |
-58.45 |
6.85 |
-8.93 |
-0.88 |
0 |
|
|
289687 |
104367158 |
1 |
ClSO2H11C13 |
ABC2D11E13 |
-28.55 |
3.21 |
-9.32 |
-1.16 |
0 |
|
|
289688 |
104367172 |
1 |
SCl2O2H6C11 |
AB2C2D6E11 |
-24.07 |
2.52 |
-9.53 |
-1.35 |
0 |
|
|
289689 |
104367255 |
1 |
BrClSO2H6C11 |
ABCD2E6F11 |
-6.94 |
2.16 |
-9.26 |
-1.44 |
0 |
|
|
289690 |
104367429 |
1 |
ON2S2H8C10 |
AB2C2D8E10 |
39.91 |
2.83 |
-8.94 |
-1.19 |
0 |
|
|
289691 |
104367477 |
1 |
OS2C10H12 |
AB2C10D12 |
-12.06 |
4.08 |
-8.83 |
-1.19 |
0 |
|
|
289692 |
104367561 |
1 |
FSN2O2C15H15 |
ABC2D2E15F15 |
-68.27 |
4.4 |
-8.56 |
-1.21 |
0 |
|
|
289693 |
104367564 |
1 |
NSO2C11H17 |
ABC2D11E17 |
-74.7 |
6.63 |
-8.37 |
-0.9 |
0 |
|
|
289694 |
104367612 |
1 |
SN2O3C9H12 |
AB2C3D9E12 |
-94.71 |
7.49 |
-9.02 |
-1.27 |
0 |
|
|
289695 |
104367763 |
1 |
NSO2C13H19 |
ABC2D13E19 |
-77.63 |
6.58 |
-8.49 |
-0.97 |
0 |
|
|
289696 |
104367945 |
1 |
SN2O2F3H5C9 |
AB2C2D3E5F9 |
-164.73 |
4.78 |
-9.85 |
-1.98 |
0 |
|
|
289697 |
104368135 |
1 |
ClNSO5H6C11 |
ABCD5E6F11 |
-70.65 |
2.18 |
-10.1 |
-2.07 |
0 |
|
|
289698 |
104368492 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-101.49 |
3.0 |
-8.87 |
-0.16 |
0 |
|
|
289699 |
104368494 |
1 |
N3O3H13C14 |
A3B3C13D14 |
-28.94 |
9.08 |
-9.47 |
-0.77 |
0 |