List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
288000 |
104306608 |
1 |
NSO2C9H19 |
ABC2D9E19 |
-112.26 |
5.42 |
-9.53 |
1.0 |
0 |
|
|
288001 |
104306619 |
1 |
BrNS2O3C14H16 |
ABC2D3E14F16 |
-83.44 |
4.54 |
-9.2 |
-0.98 |
0 |
|
|
288002 |
104306668 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-39.3 |
5.51 |
-8.81 |
-0.39 |
0 |
|
|
288003 |
104306724 |
1 |
NO2C18H21 |
AB2C18D21 |
-66.15 |
5.92 |
-8.72 |
-0.64 |
0 |
|
|
288004 |
104306736 |
1 |
ON2C17H22 |
AB2C17D22 |
-19.94 |
3.85 |
-8.59 |
-0.41 |
0 |
|
|
288005 |
104306904 |
1 |
ClN3C17H24 |
AB3C17D24 |
19.82 |
4.68 |
-8.19 |
0.55 |
0 |
|
|
288006 |
104307105 |
1 |
N2Cl3H13C14 |
A2B3C13D14 |
17.33 |
3.12 |
-8.66 |
-0.81 |
0 |
|
|
288007 |
104307123 |
1 |
ClSN3C11H12 |
ABC3D11E12 |
57.31 |
4.72 |
-8.88 |
-1.11 |
0 |
|
|
288008 |
104307126 |
1 |
ClSN3C14H18 |
ABC3D14E18 |
28.89 |
3.8 |
-8.78 |
-0.61 |
0 |
|
|
288009 |
104307212 |
1 |
ClNOSBr2H12C14 |
ABCDE2F12G14 |
0.75 |
4.2 |
-9.14 |
-1.48 |
0 |
|
|
288010 |
104307337 |
1 |
ClON2C17H19 |
ABC2D17E19 |
-31.26 |
2.3 |
-8.9 |
-0.56 |
0 |
|
|
288011 |
104307418 |
1 |
BrNO2C15H20 |
ABC2D15E20 |
-90.39 |
2.45 |
-9.03 |
-0.11 |
0 |
|
|
288012 |
104307526 |
1 |
BrNOC17H26 |
ABCD17E26 |
-70.46 |
4.58 |
-8.85 |
-0.01 |
0 |
|
|
288013 |
104307571 |
1 |
BrClNOC17H17 |
ABCDE17F17 |
-27.36 |
4.0 |
-8.97 |
-0.7 |
0 |
|
|
288014 |
104307574 |
1 |
BrNOC15H22 |
ABCD15E22 |
-63.08 |
4.42 |
-8.84 |
-0.01 |
0 |
|
|
288015 |
104307587 |
1 |
BrNOC18H20 |
ABCD18E20 |
-27.61 |
5.53 |
-8.86 |
-0.43 |
0 |
|
|
288016 |
104307607 |
1 |
BrNO2C14H18 |
ABC2D14E18 |
-84.88 |
4.85 |
-8.88 |
-0.02 |
0 |
|
|
288017 |
104307679 |
1 |
BrSN2O2C15H23 |
ABC2D2E15F23 |
-82.31 |
6.06 |
-8.84 |
-0.36 |
0 |
|
|
288018 |
104307685 |
1 |
ClNBr2O2S2H12C13 |
ABC2D2E2F12G13 |
-27.36 |
4.25 |
-9.69 |
-1.63 |
0 |
|
|
288019 |
104308388 |
1 |
ClSN2C11H15 |
ABC2D11E15 |
39.18 |
4.18 |
-9.12 |
-0.16 |
0 |
|
|
288020 |
104308403 |
1 |
Cl2N3C14H15 |
A2B3C14D15 |
33.12 |
2.79 |
-8.52 |
-0.68 |
0 |
|
|
288021 |
104308482 |
1 |
ClSN2C9H17 |
ABC2D9E17 |
8.69 |
2.04 |
-8.46 |
-0.34 |
0 |
|
|
288022 |
104308553 |
1 |
ClN2O2C6H7 |
AB2C2D6E7 |
-60.27 |
5.68 |
-10.47 |
-0.6 |
0 |
|
|
288023 |
104308622 |
1 |
ClN3C8H10 |
AB3C8D10 |
39.02 |
5.28 |
-9.09 |
-0.77 |
0 |
|
|
288024 |
104308634 |
1 |
ClO2N3C8H8 |
AB2C3D8E8 |
-35.42 |
4.72 |
-9.1 |
-0.74 |
0 |
|
|
288025 |
104308646 |
1 |
ClON2C9H9 |
ABC2D9E9 |
-11.41 |
4.37 |
-9.46 |
-0.64 |
0 |
|
|
288026 |
104308649 |
1 |
ClON2C9H9 |
ABC2D9E9 |
-7.41 |
3.28 |
-9.24 |
-0.65 |
0 |
|
|
288027 |
104308658 |
1 |
ClON3C9H10 |
ABC3D9E10 |
-13.76 |
3.37 |
-10.01 |
-0.81 |
0 |
|
|
288028 |
104308718 |
1 |
ON4C14H18 |
AB4C14D18 |
7.34 |
1.4 |
-8.52 |
-0.34 |
0 |
|
|
288029 |
104308786 |
1 |
ClNO3C11H12 |
ABC3D11E12 |
-68.65 |
4.53 |
-9.07 |
-0.48 |
0 |
|
|
288030 |
104308876 |
1 |
ClFNOH7C9 |
ABCDE7F9 |
-41.44 |
2.58 |
-9.6 |
-0.78 |
0 |
|
|
288031 |
104308896 |
1 |
ClN2O2H9C10 |
AB2C2D9E10 |
-34.9 |
4.79 |
-9.76 |
-0.99 |
0 |
|
|
288032 |
104308939 |
1 |
ClNOBr2H6C9 |
ABCD2E6F9 |
15.85 |
4.4 |
-9.99 |
-0.93 |
0 |
|
|
288033 |
104309044 |
1 |
ClN2O3H7C9 |
AB2C3D7E9 |
5.42 |
6.89 |
-10.09 |
-1.45 |
0 |
|
|
288034 |
104309182 |
1 |
ClNO2C9H16 |
ABC2D9E16 |
-91.54 |
2.38 |
-9.9 |
-0.51 |
0 |
|
|
288035 |
104309203 |
1 |
ClSN3H8C10 |
ABC3D8E10 |
70.28 |
4.46 |
-9.03 |
-0.78 |
0 |
|
|
288036 |
104309257 |
1 |
ClNOSC10H10 |
ABCDE10F10 |
1.41 |
6.17 |
-8.84 |
-0.59 |
0 |
|
|
288037 |
104309382 |
1 |
ClNO3C10H14 |
ABC3D10E14 |
-117.02 |
7.7 |
-9.33 |
0.04 |
0 |
|
|
288038 |
104309409 |
1 |
ClNO2F3C6H9 |
ABC2D3E6F9 |
-261.2 |
4.66 |
-10.48 |
-0.16 |
0 |
|
|
288039 |
104309578 |
1 |
ClNO3C10H18 |
ABC3D10E18 |
-154.44 |
7.35 |
-9.9 |
0.06 |
0 |
|
|
288040 |
104309688 |
1 |
ClNO3C9H10 |
ABC3D9E10 |
-128.31 |
1.83 |
-9.32 |
-0.74 |
0 |
|
|
288041 |
104309731 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-104.76 |
1.42 |
-8.26 |
-0.81 |
0 |
|
|
288042 |
104309824 |
1 |
NCl2O5H7C9 |
AB2C5D7E9 |
-118.97 |
3.98 |
-9.85 |
-1.69 |
0 |
|
|
288043 |
104310127 |
1 |
FO2N4H9C12 |
AB2C4D9E12 |
-35.11 |
11.92 |
-9.27 |
-1.14 |
0 |
|
|
288044 |
104310175 |
1 |
BrFN2O2H8C14 |
ABC2D2E8F14 |
-51.33 |
8.82 |
-9.6 |
-1.49 |
0 |
|
|
288045 |
104310190 |
1 |
FSN2O2H11C15 |
ABC2D2E11F15 |
-55.87 |
8.35 |
-8.75 |
-1.31 |
0 |
|
|
288046 |
104310198 |
1 |
FN2O2C16H17 |
AB2C2D16E17 |
-93.14 |
9.35 |
-9.7 |
-1.06 |
0 |
|
|
288047 |
104310216 |
1 |
FN2O2C15H15 |
AB2C2D15E15 |
-87.09 |
9.05 |
-9.68 |
-1.05 |
0 |
|
|
288048 |
104310247 |
1 |
FN2O3C15H17 |
AB2C3D15E17 |
-149.92 |
8.27 |
-9.69 |
-1.06 |
0 |
|
|
288049 |
104310256 |
1 |
FN2O2H11C15 |
AB2C2D11E15 |
-64.58 |
9.57 |
-9.34 |
-1.25 |
0 |