List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
197645 |
78983862 |
1 |
BrN2O2S2H9C12 |
AB2C2D2E9F12 |
14.84 |
4.7 |
-9.44 |
-1.27 |
0 |
|
|
197646 |
78983863 |
1 |
BrClNO2S3H7C9 |
ABCD2E3F7G9 |
-12.01 |
3.63 |
-9.4 |
-1.26 |
0 |
|
|
197647 |
78983887 |
1 |
BrN2S2O4H11C12 |
AB2C2D4E11F12 |
-34.87 |
7.09 |
-9.55 |
-1.56 |
0 |
|
|
197648 |
78983888 |
1 |
BrNS2O4H12C13 |
ABC2D4E12F13 |
-91.97 |
7.18 |
-9.28 |
-0.73 |
0 |
|
|
197649 |
78984067 |
1 |
OSF2N2H12C14 |
ABC2D2E12F14 |
-81.99 |
6.26 |
-8.6 |
-0.7 |
0 |
|
|
197650 |
78984068 |
1 |
OSN2C16H18 |
ABC2D16E18 |
13.56 |
3.46 |
-8.37 |
-0.41 |
0 |
|
|
197651 |
78984069 |
1 |
ON5C12H15 |
AB5C12D15 |
40.98 |
5.38 |
-8.72 |
-0.14 |
0 |
|
|
197652 |
78984070 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-73.53 |
4.87 |
-8.71 |
0.16 |
0 |
|
|
197653 |
78984071 |
1 |
OSBr2N2C14H14 |
ABC2D2E14F14 |
16.53 |
4.38 |
-8.75 |
-1.08 |
0 |
|
|
197654 |
78984254 |
1 |
BrON3H12C15 |
ABC3D12E15 |
43.43 |
2.72 |
-8.63 |
-0.88 |
0 |
|
|
197655 |
78984255 |
1 |
OSN2C15H16 |
ABC2D15E16 |
-4.41 |
3.03 |
-8.22 |
-0.54 |
0 |
|
|
197656 |
78984256 |
1 |
FOSN2H13C16 |
ABCD2E13F16 |
-31.09 |
4.21 |
-8.46 |
-1.22 |
0 |
|
|
197657 |
78984335 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-128.63 |
3.54 |
-8.98 |
-0.21 |
0 |
|
|
197658 |
78984336 |
1 |
ClN2O2C16H17 |
AB2C2D16E17 |
-47.26 |
3.67 |
-8.69 |
-0.34 |
0 |
|
|
197659 |
78984531 |
2 |
NOC7H11 |
ABC7D11 |
-97.41 |
3.32 |
-8.11 |
0.44 |
0 |
|
|
197660 |
78984611 |
1 |
N2O3C13H22 |
A2B3C13D22 |
-126.58 |
4.43 |
-8.86 |
0.64 |
0 |
|
|
197661 |
78984680 |
1 |
FN2O2C16H17 |
AB2C2D16E17 |
-83.9 |
4.67 |
-8.82 |
-0.32 |
0 |
|
|
197662 |
78984718 |
1 |
FON2C17H19 |
ABC2D17E19 |
-58.52 |
2.39 |
-9.39 |
-0.26 |
0 |
|
|
197663 |
78984719 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-49.73 |
1.65 |
-9.53 |
0.03 |
0 |
|
|
197664 |
78984720 |
1 |
ClOSN2C16H19 |
ABCD2E16F19 |
-3.78 |
2.44 |
-9.34 |
-0.75 |
0 |
|
|
197665 |
78985613 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-90.57 |
2.6 |
-9.38 |
0.33 |
0 |
|
|
197666 |
78985750 |
1 |
ON2C15H22 |
AB2C15D22 |
-16.46 |
3.56 |
-9.45 |
0.2 |
0 |
|
|
197667 |
78985868 |
1 |
BrOSN3H8C9 |
ABCD3E8F9 |
28.05 |
4.05 |
-9.48 |
-0.76 |
0 |
|
|
197668 |
78986060 |
1 |
BrNOSCl2H10C13 |
ABCDE2F10G13 |
-15.18 |
1.77 |
-9.44 |
-0.7 |
0 |
|
|
197669 |
78986315 |
1 |
OSN2C13H14 |
ABC2D13E14 |
-7.4 |
2.36 |
-8.74 |
-0.25 |
0 |
|
|
197670 |
78986316 |
1 |
OSBr2N2H8C9 |
ABC2D2E8F9 |
17.72 |
2.59 |
-9.77 |
-1.51 |
0 |
|
|
197671 |
78986563 |
1 |
SO2N3C13H21 |
AB2C3D13E21 |
-44.61 |
5.67 |
-9.21 |
-0.7 |
0 |
|
|
197672 |
78986564 |
1 |
BrSO2N3C13H20 |
ABC2D3E13F20 |
-51.02 |
3.9 |
-9.38 |
-0.92 |
0 |
|
|
197673 |
78986579 |
1 |
OSN2C9H12 |
ABC2D9E12 |
-7.82 |
3.54 |
-9.53 |
-0.53 |
0 |
|
|
197674 |
78987110 |
1 |
FN4O4H7C10 |
AB4C4D7E10 |
-39.12 |
1.44 |
-10.66 |
-2.36 |
0 |
|
|
197675 |
78987111 |
1 |
O2N5C13H13 |
A2B5C13D13 |
66.67 |
7.47 |
-9.36 |
-1.39 |
0 |
|
|
197676 |
78987112 |
1 |
N6C13H16 |
A6B13C16 |
105.29 |
5.49 |
-9.06 |
-1.31 |
0 |
|
|
197677 |
78987113 |
1 |
NO4C14H19 |
AB4C14D19 |
-162.68 |
4.52 |
-9.35 |
0.14 |
0 |
|
|
197678 |
78987114 |
1 |
ClNO3C15H18 |
ABC3D15E18 |
-128.53 |
3.2 |
-9.59 |
-0.6 |
0 |
|
|
197679 |
78987115 |
1 |
N2O3C12H26 |
A2B3C12D26 |
-153.17 |
1.4 |
-9.15 |
1.17 |
0 |
|
|
197680 |
78987152 |
1 |
SO2N4C9H10 |
AB2C4D9E10 |
-20.54 |
7.89 |
-9.83 |
-1.62 |
0 |
|
|
197681 |
78987153 |
1 |
ClNO3C15H18 |
ABC3D15E18 |
-130.31 |
3.41 |
-9.62 |
-0.6 |
0 |
|
|
197682 |
78987154 |
1 |
ON3C15H23 |
AB3C15D23 |
-13.37 |
3.16 |
-9.06 |
-0.17 |
0 |
|
|
197683 |
78987155 |
2 |
NOC8H13 |
ABC8D13 |
-85.65 |
3.58 |
-8.98 |
0.31 |
0 |
|
|
197684 |
78987156 |
1 |
ON3C14H27 |
AB3C14D27 |
-76.08 |
3.42 |
-8.79 |
1.18 |
0 |
|
|
197685 |
78987157 |
1 |
SO2N4H8C11 |
AB2C4D8E11 |
36.74 |
4.46 |
-9.54 |
-1.64 |
0 |
|
|
197686 |
78987193 |
1 |
ClN2O3C9H9 |
AB2C3D9E9 |
-103.43 |
6.63 |
-10.45 |
-1.54 |
0 |
|
|
197687 |
78987282 |
1 |
ClON3C15H22 |
ABC3D15E22 |
-13.07 |
3.91 |
-8.6 |
-0.45 |
0 |
|
|
197688 |
78987283 |
1 |
ON4C14H22 |
AB4C14D22 |
7.31 |
3.76 |
-9.19 |
-0.47 |
0 |
|
|
197689 |
78987284 |
1 |
BrON4C14H21 |
ABC4D14E21 |
6.16 |
3.29 |
-9.11 |
-0.85 |
0 |
|
|
197690 |
78987285 |
1 |
ON5C13H21 |
AB5C13D21 |
27.67 |
3.32 |
-9.38 |
-0.9 |
0 |
|
|
197691 |
78987286 |
1 |
ON4C14H22 |
AB4C14D22 |
7.82 |
3.25 |
-9.15 |
-0.52 |
0 |
|
|
197692 |
78987287 |
1 |
ClON4C14H21 |
ABC4D14E21 |
0.6 |
3.91 |
-9.11 |
-0.76 |
0 |
|
|
197693 |
78987288 |
1 |
ClON4C14H21 |
ABC4D14E21 |
-1.61 |
3.76 |
-9.33 |
-0.73 |
0 |
|
|
197694 |
78987289 |
1 |
ON3C15H23 |
AB3C15D23 |
-3.45 |
4.24 |
-8.84 |
-0.21 |
0 |