List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
245700 |
103023001 |
1 |
SO3N4C9H18 |
AB3C4D9E18 |
-96.95 |
4.15 |
-10.48 |
-0.39 |
0 |
|
|
245701 |
103023006 |
1 |
SO3N4C8H16 |
AB3C4D8E16 |
-93.1 |
6.87 |
-10.3 |
-0.3 |
0 |
|
|
245702 |
103023010 |
1 |
ClN2O2C11H15 |
AB2C2D11E15 |
-79.26 |
7.21 |
-9.15 |
-0.36 |
0 |
|
|
245703 |
103023015 |
1 |
ClO2N3C9H12 |
AB2C3D9E12 |
-54.22 |
6.27 |
-9.91 |
-0.8 |
0 |
|
|
245704 |
103023018 |
1 |
ClO2N3C10H14 |
AB2C3D10E14 |
-65.25 |
5.85 |
-9.31 |
-0.82 |
0 |
|
|
245705 |
103023019 |
1 |
ClO2N3C14H16 |
AB2C3D14E16 |
-46.2 |
3.69 |
-9.06 |
-1.03 |
0 |
|
|
245706 |
103023023 |
1 |
FNSO4C11H14 |
ABCD4E11F14 |
-208.99 |
3.44 |
-9.55 |
-0.95 |
0 |
|
|
245707 |
103023029 |
1 |
IN2O2C7H11 |
AB2C2D7E11 |
-27.28 |
2.66 |
-10.05 |
-2.14 |
0 |
|
|
245708 |
103023040 |
1 |
O2C13H18 |
A2B13C18 |
-84.1 |
3.51 |
-9.28 |
0.36 |
0 |
|
|
245709 |
103023041 |
1 |
ClO2C13H17 |
AB2C13D17 |
-93.24 |
3.05 |
-9.42 |
-0.26 |
0 |
|
|
245710 |
103023066 |
1 |
NO2C11H15 |
AB2C11D15 |
-65.71 |
1.88 |
-10.02 |
-0.64 |
0 |
|
|
245711 |
103023069 |
1 |
SO2C10H14 |
AB2C10D14 |
-71.6 |
3.66 |
-9.1 |
-0.72 |
0 |
|
|
245712 |
103023070 |
1 |
O2C15H22 |
A2B15C22 |
-100.69 |
3.72 |
-8.79 |
0.53 |
0 |
|
|
245713 |
103023073 |
2 |
OC7H14 |
AB7C14 |
-143.95 |
3.65 |
-9.8 |
0.88 |
0 |
|
|
245714 |
103023075 |
2 |
NOC5H8 |
ABC5D8 |
-60.3 |
2.16 |
-9.75 |
0.05 |
0 |
|
|
245715 |
103023077 |
1 |
ON2C13H22 |
AB2C13D22 |
-49.52 |
5.02 |
-8.51 |
1.05 |
0 |
|
|
245716 |
103023099 |
1 |
FO2C12H15 |
AB2C12D15 |
-119.24 |
4.16 |
-9.81 |
-0.5 |
0 |
|
|
245717 |
103023104 |
1 |
NO3C15H21 |
AB3C15D21 |
-118.31 |
4.32 |
-9.2 |
-0.28 |
0 |
|
|
245718 |
103023107 |
1 |
O2C15H30 |
A2B15C30 |
-149.41 |
1.82 |
-9.89 |
0.63 |
0 |
|
|
245719 |
103023110 |
2 |
OC6H12 |
AB6C12 |
-134.42 |
1.82 |
-9.88 |
0.64 |
0 |
|
|
245720 |
103023114 |
1 |
NO2C13H27 |
AB2C13D27 |
-122.71 |
2.06 |
-8.82 |
2.19 |
0 |
|
|
245721 |
103023116 |
1 |
O2C17H20 |
A2B17C20 |
-67.76 |
3.38 |
-8.68 |
-0.33 |
0 |
|
|
245722 |
103023119 |
1 |
ClFO2C13H16 |
ABC2D13E16 |
-140.23 |
1.88 |
-9.67 |
-0.59 |
0 |
|
|
245723 |
103023122 |
1 |
BrSO2C11H15 |
ABC2D11E15 |
-70.86 |
3.81 |
-9.32 |
-0.42 |
0 |
|
|
245724 |
103023129 |
1 |
Cl2O2C13H16 |
A2B2C13D16 |
-99.26 |
3.27 |
-9.47 |
-0.53 |
0 |
|
|
245725 |
103023131 |
1 |
BrFO2C13H16 |
ABC2D13E16 |
-129.05 |
3.9 |
-9.57 |
-0.35 |
0 |
|
|
245726 |
103023134 |
1 |
BrFO2C13H16 |
ABC2D13E16 |
-128.15 |
3.54 |
-9.54 |
-0.47 |
0 |
|
|
245727 |
103023135 |
1 |
SO2C11H16 |
AB2C11D16 |
-76.57 |
3.25 |
-9.04 |
-0.27 |
0 |
|
|
245728 |
103023137 |
2 |
OC6H12 |
AB6C12 |
-135.69 |
3.44 |
-9.8 |
0.84 |
0 |
|
|
245729 |
103023138 |
2 |
OC8H16 |
AB8C16 |
-154.39 |
1.84 |
-9.89 |
0.63 |
0 |
|
|
245730 |
103023142 |
2 |
OC6H11 |
AB6C11 |
-125.42 |
2.96 |
-9.79 |
0.68 |
0 |
|
|
245731 |
103023143 |
1 |
BrSO2C11H15 |
ABC2D11E15 |
-76.22 |
4.8 |
-9.19 |
-0.47 |
0 |
|
|
245732 |
103023145 |
1 |
FN3C12H20 |
AB3C12D20 |
-42.42 |
2.4 |
-9.46 |
0.83 |
0 |
|
|
245733 |
103023147 |
1 |
O2C15H22 |
A2B15C22 |
-93.2 |
2.32 |
-9.42 |
0.33 |
0 |
|
|
245734 |
103023151 |
1 |
FN3C11H18 |
AB3C11D18 |
-33.08 |
2.61 |
-9.24 |
0.74 |
0 |
|
|
245735 |
103023152 |
1 |
FN3C11H18 |
AB3C11D18 |
-32.04 |
4.84 |
-9.12 |
0.75 |
0 |
|
|
245736 |
103023154 |
1 |
FN3C11H18 |
AB3C11D18 |
-29.35 |
3.43 |
-9.18 |
0.82 |
0 |
|
|
245737 |
103023156 |
2 |
OC7H10 |
AB7C10 |
-92.44 |
2.42 |
-9.31 |
0.01 |
0 |
|
|
245738 |
103023162 |
1 |
FN3C12H20 |
AB3C12D20 |
-27.5 |
2.53 |
-8.78 |
0.74 |
0 |
|
|
245739 |
103023169 |
1 |
O2F3C13H15 |
A2B3C13D15 |
-238.03 |
6.19 |
-10.26 |
-0.78 |
0 |
|
|
245740 |
103023171 |
1 |
FN3C13H20 |
AB3C13D20 |
-30.15 |
2.7 |
-9.1 |
0.77 |
0 |
|
|
245741 |
103023173 |
2 |
ClOC6H7 |
ABC6D7 |
-88.32 |
4.6 |
-9.71 |
-0.86 |
0 |
|
|
245742 |
103023184 |
1 |
FN3C10H18 |
AB3C10D18 |
-33.59 |
4.83 |
-9.32 |
0.98 |
0 |
|
|
245743 |
103023185 |
1 |
FO2C13H17 |
AB2C13D17 |
-133.11 |
2.02 |
-9.91 |
-0.68 |
0 |
|
|
245744 |
103023186 |
1 |
FN3C10H18 |
AB3C10D18 |
-33.0 |
2.9 |
-9.08 |
0.94 |
0 |
|
|
245745 |
103023187 |
1 |
FO2C13H17 |
AB2C13D17 |
-131.2 |
1.58 |
-9.84 |
-0.72 |
0 |
|
|
245746 |
103023332 |
1 |
BrN2O2C14H23 |
AB2C2D14E23 |
-82.53 |
3.86 |
-9.14 |
0.19 |
0 |
|
|
245747 |
103023442 |
1 |
NO3C12H25 |
AB3C12D25 |
-173.35 |
4.44 |
-9.38 |
0.84 |
0 |
|
|
245748 |
103023483 |
1 |
ClFO2C13H16 |
ABC2D13E16 |
-140.42 |
2.38 |
-9.54 |
-0.36 |
0 |
|
|
245749 |
103023484 |
1 |
ON3C16H19 |
AB3C16D19 |
16.23 |
3.22 |
-9.21 |
0.2 |
0 |